1-cyclohexyl-4-(6-methoxyquinolin-8-yl)-2-piperazin-1-yl-indole-6-carbonitrile

Systemtic Name: 1-cyclohexyl-4-(6-methoxyquinolin-8-yl)-2-piperazin-1-yl-indole-6-carbonitrile Openeye Name: 1-cyclohexyl-4-(6-methoxy-8-quinolyl)-2-piperazin-1-yl-indole-6-carbonitrile CAS Name: 1-cyclohexyl-4-(6-methoxy-8-quinolinyl)-2-(1-piperazinyl)-6-indolecarbonitrile IUPAC Name: 1-cyclohexyl-4-(6-methoxyquinolin-8-yl)-2-piperazin-1-ylindole-6-carbonitrile Traditional Name: 1-cyclohexyl-4-(6-methoxy-8-quinolyl)-2-piperazino-indole-6-carbonitrile Formula: C29H31N5O MolecularWeight: 465.58934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C=CC=N2)C3=C4C=C(N(C4=CC(=C3)C#N)C5CCCCC5)N6CCNCC6

Isomeric SMILES

COC1=CC(=C2C(=C1)C=CC=N2)C3=C4C=C(N(C4=CC(=C3)C#N)C5CCCCC5)N6CCNCC6

InChI

InChI=1S/C29H31N5O/c1-35-23-16-21-6-5-9-32-29(21)26(17-23)24-14-20(19-30)15-27-25(24)18-28(33-12-10-31-11-13-33)34(27)22-7-3-2-4-8-22/h5-6,9,14-18,22,31H,2-4,7-8,10-13H2,1H3