3-(cyclohexylmethyl)-5-[cyclopentyl(prop-2-enyl)amino]-6-phenylazanyl-1H-benzimidazol-2-one

Systemtic Name: 3-(cyclohexylmethyl)-5-[cyclopentyl(prop-2-enyl)amino]-6-phenylazanyl-1H-benzimidazol-2-one Openeye Name: 5-[allyl(cyclopentyl)amino]-6-anilino-3-(cyclohexylmethyl)-1H-benzimidazol-2-one CAS Name: 6-anilino-3-(cyclohexylmethyl)-5-[cyclopentyl(prop-2-enyl)amino]-1H-benzimidazol-2-one IUPAC Name: 6-anilino-3-(cyclohexylmethyl)-5-[cyclopentyl(prop-2-enyl)amino]-1H-benzimidazol-2-one Traditional Name: 5-[allyl(cyclopentyl)amino]-6-anilino-3-(cyclohexylmethyl)-1H-benzimidazol-2-one Formula: C28H36N4O MolecularWeight: 444.61164

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1CCCC1)C2=C(C=C3C(=C2)N(C(=O)N3)CC4CCCCC4)NC5=CC=CC=C5

Isomeric SMILES

C=CCN(C1CCCC1)C2=C(C=C3C(=C2)N(C(=O)N3)CC4CCCCC4)NC5=CC=CC=C5

InChI

InChI=1S/C28H36N4O/c1-2-17-31(23-15-9-10-16-23)26-19-27-25(18-24(26)29-22-13-7-4-8-14-22)30-28(33)32(27)20-21-11-5-3-6-12-21/h2,4,7-8,13-14,18-19,21,23,29H,1,3,5-6,9-12,15-17,20H2,(H,30,33)