3-(cyclohexylmethyl)-5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-6-phenylazanyl-1H-benzimidazol-2-one

Systemtic Name: 3-(cyclohexylmethyl)-5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-6-phenylazanyl-1H-benzimidazol-2-one Openeye Name: 6-anilino-3-(cyclohexylmethyl)-5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-1H-benzimidazol-2-one CAS Name: 6-anilino-3-(cyclohexylmethyl)-5-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-1H-benzimidazol-2-one IUPAC Name: 6-anilino-3-(cyclohexylmethyl)-5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-1H-benzimidazol-2-one Traditional Name: 6-anilino-3-(cyclohexylmethyl)-5-[(3S)-3-(dimethylamino)pyrrolidino]-1H-benzimidazol-2-one Formula: C26H35N5O MolecularWeight: 433.589

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)C2=C(C=C3C(=C2)N(C(=O)N3)CC4CCCCC4)NC5=CC=CC=C5

Isomeric SMILES

CN(C)[C@H]1CCN(C1)C2=C(C=C3C(=C2)N(C(=O)N3)CC4CCCCC4)NC5=CC=CC=C5

InChI

InChI=1S/C26H35N5O/c1-29(2)21-13-14-30(18-21)24-16-25-23(15-22(24)27-20-11-7-4-8-12-20)28-26(32)31(25)17-19-9-5-3-6-10-19/h4,7-8,11-12,15-16,19,21,27H,3,5-6,9-10,13-14,17-18H2,1-2H3,(H,28,32)/t21-/m0/s1