NAVARIXIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H26N2O5.H2O
Molecular Weight	428.4782
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.CCC[C@@H](NC1=C(CC2=C(O)C(=CC=C2)C(=O)N(C)C)C(=O)C1=O)C3=CC=C(C)O3

InChI

InChIKey=OVPWPDFETBKAQQ-UNTBIKODSA-N

InChI=1S/C23H26N2O5.H2O/c1-5-7-17(18-11-10-13(2)30-18)24-19-16(21(27)22(19)28)12-14-8-6-9-15(20(14)26)23(29)25(3)4;/h6,8-11,17,24,26H,5,7,12H2,1-4H3;1H2/t17-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C23H26N2O5
Molecular Weight	410.4629
Charge	0
Count

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

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:37:41 UTC 2023` Edited by `admin` on `Sat Dec 16 01:37:41 UTC 2023`
Record UNII	7V3BY6G538
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NAVARIXIN

Official Name

English

MK-7123 MONOHYDRATE

Code

English

2-HYDROXY-N,N-DIMETHYL-3-((2-((1R)-1-(5-METHYLFURAN-2-YL)PROPYL)AMINE)-3,4- DIOXOCYCLOBUT-1-ENYL)AMINO)BENZAMIDE MONOHYDRATE

Common Name

English

PS291822

Code

English

SCH-527123 MONOHYDRATE

Code

English

PS-291822

Code

English

BENZAMIDE, 2-HYDROXY-N,N-DIMETHYL-3-((2-(((1R)-1-(5-METHYL-2-FURANYL)PROPYL)AMINO)- 3,4-DIOXO-1-CYCLOBUTEN-1-YL)AMINO)-, HYDRATE (1:1)

Systematic Name

English

NAVARIXIN [USAN]

Common Name

English

NAVARIXIN MONOHYDRATE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID20235453