(2R)-2-ACETAMIDO-3-((4E)-4-((3-METHYL-1,1-DIOXO-1,4-THIAZINAN-4-YL)IMINO)-3-OXO-BUTYL)SULFANYLPROPANOIC ACID

Details

Stereochemistry	EPIMERIC
Molecular Formula	C14H23N3O6S2
Molecular Weight	393.479
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of (2R)-2-ACETAMIDO-3-((4E)-4-((3-METHYL-1,1-DIOXO-1,4-THIAZINAN-4-YL)IMINO)-3-OXO-BUTYL)SULFANYLPROPANOIC ACID

Structure Search

SMILES

CC1CS(=O)(=O)CCN1\N=C\C(=O)CCSC[C@H](NC(C)=O)C(O)=O

InChI

InChIKey=VMJPACANYZLDSX-VVQUDCGKSA-N

InChI=1S/C14H23N3O6S2/c1-10-9-25(22,23)6-4-17(10)15-7-12(19)3-5-24-8-13(14(20)21)16-11(2)18/h7,10,13H,3-6,8-9H2,1-2H3,(H,16,18)(H,20,21)/b15-7+/t10?,13-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

(2R)-2-ACETAMIDO-3-((4E)-4-((3-METHYL-1,1-DIOXO-1,4-THIAZINAN-4-YL)IMINO)-3-OXO-BUTYL)SULFANYLPROPANOIC ACID

Systematic Name

English

NIFURTIMOX METABOLITE M-8

Common Name

English

Code System Code Type Description

PUBCHEM

165412061

Created by admin on Sat Dec 16 17:55:24 GMT 2023 , Edited by admin on Sat Dec 16 17:55:24 GMT 2023

PRIMARY

FDA UNII

GR9A2C3NUO

Created by admin on Sat Dec 16 17:55:24 GMT 2023 , Edited by admin on Sat Dec 16 17:55:24 GMT 2023

PRIMARY

PARENT (METABOLITE)


					M84I3K7C2O

NIFURTIMOX

SUBSTANCE RECORD


					GR9A2C3NUO

(2R)-2-ACETAMIDO-3-((4E)-4-((3-METHYL-1,1-DIOXO-1,4-THIAZINAN-4-YL)IMINO)-3-OXO-BUTYL)SULFANYLPROPANOIC ACID