2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-methyl-amino]-N-(2-bromophenyl)ethanamide

Systemtic Name: 2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-methyl-amino]-N-(2-bromophenyl)ethanamide Openeye Name: 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]-methyl-amino]-N-(2-bromophenyl)acetamide CAS Name: 2-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]-methylamino]-N-(2-bromophenyl)acetamide IUPAC Name: 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]-methylamino]-N-(2-bromophenyl)acetamide Traditional Name: 2-[[2-(1H-benzimidazol-2-ylthio)acetyl]-methyl-amino]-N-(2-bromophenyl)acetamide Formula: C18H17BrN4O2S MolecularWeight: 433.32218

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H17BrN4O2S/c1-23(10-16(24)20-13-7-3-2-6-12(13)19)17(25)11-26-18-21-14-8-4-5-9-15(14)22-18/h2-9H,10-11H2,1H3,(H,20,24)(H,21,22)