4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]-cyclopropylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-cyclopropylamino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC=C(C=C4)CSC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC=C(C=C4)CSC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C29H28N4O2S/c34-27(30-23-13-14-23)21-9-5-19(6-10-21)17-33(24-15-16-24)28(35)22-11-7-20(8-12-22)18-36-29-31-25-3-1-2-4-26(25)32-29/h1-12,23-24H,13-18H2,(H,30,34)(H,31,32)