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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H28N4O5S
Molecular Weight 424.514
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DE(DICHLORO)-(S-CYSTEINYL) HYDROXY BENDAMUSTINE

SMILES

CN1C(CCCC(O)=O)=NC2=C1C=CC(=C2)N(CCO)CCSC[C@H](N)C(O)=O

InChI

InChIKey=DZJFLXGFUNUDNU-AWEZNQCLSA-N
InChI=1S/C19H28N4O5S/c1-22-16-6-5-13(11-15(16)21-17(22)3-2-4-18(25)26)23(7-9-24)8-10-29-12-14(20)19(27)28/h5-6,11,14,24H,2-4,7-10,12,20H2,1H3,(H,25,26)(H,27,28)/t14-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DE(DICHLORO)-(S-CYSTEINYL) HYDROXY BENDAMUSTINE
Common Name English
1H-BENZIMIDAZOLE-2-BUTANOIC ACID, 5-((2-(((2R)-2-AMINO-2-CARBOXYETHYL)THIO)ETHYL)(2-HYDROXYETHYL)AMINO)-1-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
8BA9X9NB6C
Created by admin on Sat Dec 16 09:15:14 GMT 2023 , Edited by admin on Sat Dec 16 09:15:14 GMT 2023
PRIMARY
PUBCHEM
156596445
Created by admin on Sat Dec 16 09:15:14 GMT 2023 , Edited by admin on Sat Dec 16 09:15:14 GMT 2023
PRIMARY
CAS
862510-73-4
Created by admin on Sat Dec 16 09:15:14 GMT 2023 , Edited by admin on Sat Dec 16 09:15:14 GMT 2023
PRIMARY