3-(cyclohexylmethyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-6-phenylazanyl-1H-benzimidazol-2-one

Systemtic Name: 3-(cyclohexylmethyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-6-phenylazanyl-1H-benzimidazol-2-one Openeye Name: 6-anilino-3-(cyclohexylmethyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-1H-benzimidazol-2-one CAS Name: 6-anilino-3-(cyclohexylmethyl)-5-[4-(4-nitrophenyl)-1-piperazinyl]-1H-benzimidazol-2-one IUPAC Name: 6-anilino-3-(cyclohexylmethyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-1H-benzimidazol-2-one Traditional Name: 6-anilino-3-(cyclohexylmethyl)-5-[4-(4-nitrophenyl)piperazino]-1H-benzimidazol-2-one Formula: C30H34N6O3 MolecularWeight: 526.62936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=CC(=C(C=C3NC2=O)NC4=CC=CC=C4)N5CCN(CC5)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)CN2C3=CC(=C(C=C3NC2=O)NC4=CC=CC=C4)N5CCN(CC5)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C30H34N6O3/c37-30-32-27-19-26(31-23-9-5-2-6-10-23)28(20-29(27)35(30)21-22-7-3-1-4-8-22)34-17-15-33(16-18-34)24-11-13-25(14-12-24)36(38)39/h2,5-6,9-14,19-20,22,31H,1,3-4,7-8,15-18,21H2,(H,32,37)