N-[3-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]phenyl]-2-methyl-cyclopropane-1-carboxamide

Systemtic Name: N-[3-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]phenyl]-2-methyl-cyclopropane-1-carboxamide Openeye Name: N-[3-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]amino]carbamoyl]phenyl]-2-methyl-cyclopropanecarboxamide CAS Name: N-[3-[[[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]phenyl]-2-methyl-1-cyclopropanecarboxamide IUPAC Name: N-[3-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]amino]carbamoyl]phenyl]-2-methylcyclopropane-1-carboxamide Traditional Name: N-[3-[[[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]amino]carbamoyl]phenyl]-2-methyl-cyclopropanecarboxamide Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H25N5O3S/c1-16-13-21(16)26(35)28-20-6-4-5-19(14-20)25(34)32-31-24(33)18-11-9-17(10-12-18)15-36-27-29-22-7-2-3-8-23(22)30-27/h2-12,14,16,21H,13,15H2,1H3,(H,28,35)(H,29,30)(H,31,33)(H,32,34)