U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H17F2N5OS
Molecular Weight 437.465
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RAVUCONAZOLE

SMILES

C[C@@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@](O)(CN3C=NC=N3)C4=C(F)C=C(F)C=C4

InChI

InChIKey=OPAHEYNNJWPQPX-RCDICMHDSA-N
InChI=1S/C22H17F2N5OS/c1-14(21-28-20(10-31-21)16-4-2-15(9-25)3-5-16)22(30,11-29-13-26-12-27-29)18-7-6-17(23)8-19(18)24/h2-8,10,12-14,30H,11H2,1H3/t14-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H17F2N5OS
Molecular Weight 437.465
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:16:51 UTC 2023
Edited
by admin
on Sat Dec 16 17:16:51 UTC 2023
Record UNII
95YH599JWV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RAVUCONAZOLE
INN   MART.   MI  
INN  
Official Name English
Benzonitrile, 4-[2-[(1R,2R)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]-
Systematic Name English
BMS-207147
Code English
Benzonitrile, 4-[2-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]-, [R-(R*,R*)]-
Systematic Name English
RAVUCONAZOLE [MI]
Common Name English
RAVUCONAZOLE [MART.]
Common Name English
ravuconazole [INN]
Common Name English
Ravuconazole [WHO-DD]
Common Name English
4-[2-[(1R,2R)-2-(2,4-Difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]benzonitrile
Systematic Name English
ER-30346
Code English
Classification Tree Code System Code
NCI_THESAURUS C514
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
Code System Code Type Description
PUBCHEM
467825
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
EPA CompTox
DTXSID40171329
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
SMS_ID
300000042684
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
CAS
182760-06-1
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
NCI_THESAURUS
C38688
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
CHEBI
143825
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
MERCK INDEX
m9509
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY Merck Index
DRUG BANK
DB06440
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
WIKIPEDIA
Ravuconazole
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
INN
8000
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
FDA UNII
95YH599JWV
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
ChEMBL
CHEMBL294029
Created by admin on Sat Dec 16 17:16:52 UTC 2023 , Edited by admin on Sat Dec 16 17:16:52 UTC 2023
PRIMARY
Related Record Type Details
PRODRUG -> METABOLITE ACTIVE
Related Record Type Details
ACTIVE MOIETY