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Details

Stereochemistry ACHIRAL
Molecular Formula C19H27Cl2N3O2
Molecular Weight 400.343
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Bendamustine Isopropyl Ester

SMILES

CC(C)OC(=O)CCCC1=NC2=CC(=CC=C2N1C)N(CCCl)CCCl

InChI

InChIKey=TZFYAAMUDJPIML-UHFFFAOYSA-N
InChI=1S/C19H27Cl2N3O2/c1-14(2)26-19(25)6-4-5-18-22-16-13-15(7-8-17(16)23(18)3)24(11-9-20)12-10-21/h7-8,13-14H,4-6,9-12H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Bendamustine Isopropyl Ester
Common Name English
Isopropyl 4-(5-(bis(2-chloroethyl)amino)-1-methyl-1H-benzo[d]imidazol-2-yl)butanoate
Systematic Name English
Bendamustine Impurity C
Common Name English
Propan-2-yl 4-{5-[bis(2-chloroethyl)amino]-1-methyl-1H-1,3-benzodiazol-2-yl}butanoate
Systematic Name English
Bendamustine 1-Methylethyl Ester
Common Name English
1-Methylethyl 5-[bis(2-chloroethyl)amino]-1-methyl-1H-Benzimidazole-2-butanoate
Systematic Name English
4-{5-[Bis-(2-chloroethyl)amino]-1-methyl 1h-benzoimidazol-2-yl}-butyric acid isopropyl ester
Systematic Name English
1H-Benzimidazole-2-butanoic acid, 5-[bis(2-chloroethyl)amino]-1-methyl-, 1-methylethyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
YQJ22VX3NT
Created by admin on Sat Dec 16 19:49:14 GMT 2023 , Edited by admin on Sat Dec 16 19:49:14 GMT 2023
PRIMARY
PUBCHEM
53258886
Created by admin on Sat Dec 16 19:49:14 GMT 2023 , Edited by admin on Sat Dec 16 19:49:14 GMT 2023
PRIMARY
CAS
1313020-25-5
Created by admin on Sat Dec 16 19:49:14 GMT 2023 , Edited by admin on Sat Dec 16 19:49:14 GMT 2023
PRIMARY