FOSRAVUCONAZOLE L-LYSINE ETHANOLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H20F2N5O5PS.C6H14N2O2.C2H6O
Molecular Weight	739.727
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of FOSRAVUCONAZOLE L-LYSINE ETHANOLATE

Structure Search

SMILES

CCO.NCCCC[C@H](N)C(O)=O.C[C@@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@@](CN3C=NC=N3)(OCOP(O)(O)=O)C4=CC=C(F)C=C4F

InChI

InChIKey=VOWYGLHOVNSCSA-NRVKWRQJSA-N

InChI=1S/C23H20F2N5O5PS.C6H14N2O2.C2H6O/c1-15(22-29-21(10-37-22)17-4-2-16(9-26)3-5-17)23(11-30-13-27-12-28-30,34-14-35-36(31,32)33)19-7-6-18(24)8-20(19)25;7-4-2-1-3-5(8)6(9)10;1-2-3/h2-8,10,12-13,15H,11,14H2,1H3,(H2,31,32,33);5H,1-4,7-8H2,(H,9,10);3H,2H2,1H3/t15-,23+;5-;/m00./s1

HIDE SMILES / InChI

Molecular Formula	C2H6O
Molecular Weight	46.0684
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C6H14N2O2
Molecular Weight	146.1876
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C23H20F2N5O5PS
Molecular Weight	547.471
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 `Fri Dec 15 15:53:01 UTC 2023` Edited by `admin` on `Fri Dec 15 15:53:01 UTC 2023`
Record UNII	QC4G8XS0H0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FOSRAVUCONAZOLE L-LYSINE ETHANOLATE

Common Name

English

((1R,2R)-2-(4-(4-CYANOPHENYL)-2-THIAZOLYL)-1-(2,4-DIFLUOROPHENYL)-1-(1H-1,2,4-TRIAZOL-1-YLMETHYL)PROPOXY) METHYL ESTER COMPOUND WITH LYSINE, ETHANOLATE (1:1:1)

Systematic Name

English

FOSRAVUCONAZOLE L-LYSINE ETHANOLATE [MI]

Common Name

English

FOSRAVUCONAZOLE L-LYSINE ETHANOLATE [JAN]

Common Name

English

Fosravuconazole L-lysine ethanolate [WHO-DD]

Common Name

English

L-LYSINE, COMPD. WITH 4-(2-((1R,2R)-2-(2,4-DIFLUOROPHENYL)-1-METHYL-2-((PHOSPHONOOXY)METHOXY)-3-(1H-1,2,4-TRIAZOL-1-YL)PROPYL)-4-THIAZOLYL)BENZONITRILE AND ETHANOL (1:1:1)

Systematic Name

English

Code System Code Type Description

CAS

914361-45-8