N-(2-chloranyl-5-methyl-phenyl)-4-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(2-chloranyl-5-methyl-phenyl)-4-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-N-(2-chloro-5-methyl-phenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-N-(2-chloro-5-methylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-N-(2-chloro-5-methylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-N-(2-chloro-5-methyl-phenyl)-1,4-diazepane-1-carboxamide Formula: C28H28ClN5O2 MolecularWeight: 502.00722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)N2CCCN(CC2)CC3=NC4=C(N3)C=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)N2CCCN(CC2)CC3=NC4=C(N3)C=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H28ClN5O2/c1-19-8-10-22(29)24(16-19)32-28(36)34-13-5-12-33(14-15-34)18-26-30-23-11-9-21(17-25(23)31-26)27(35)20-6-3-2-4-7-20/h2-4,6-11,16-17H,5,12-15,18H2,1H3,(H,30,31)(H,32,36)