2-cyclohexyl-3-[4-(6-methoxy-4-methyl-quinolin-8-yl)piperazin-1-yl]-1-methyl-indole-5-carbonitrile

Systemtic Name: 2-cyclohexyl-3-[4-(6-methoxy-4-methyl-quinolin-8-yl)piperazin-1-yl]-1-methyl-indole-5-carbonitrile Openeye Name: 2-cyclohexyl-3-[4-(6-methoxy-4-methyl-8-quinolyl)piperazin-1-yl]-1-methyl-indole-5-carbonitrile CAS Name: 2-cyclohexyl-3-[4-(6-methoxy-4-methyl-8-quinolinyl)-1-piperazinyl]-1-methyl-5-indolecarbonitrile IUPAC Name: 2-cyclohexyl-3-[4-(6-methoxy-4-methylquinolin-8-yl)piperazin-1-yl]-1-methylindole-5-carbonitrile Traditional Name: 2-cyclohexyl-3-[4-(6-methoxy-4-methyl-8-quinolyl)piperazino]-1-methyl-indole-5-carbonitrile Formula: C31H35N5O MolecularWeight: 493.6425

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=C(C2=NC=C1)N3CCN(CC3)C4=C(N(C5=C4C=C(C=C5)C#N)C)C6CCCCC6)OC

Isomeric SMILES

CC1=C2C=C(C=C(C2=NC=C1)N3CCN(CC3)C4=C(N(C5=C4C=C(C=C5)C#N)C)C6CCCCC6)OC

InChI

InChI=1S/C31H35N5O/c1-21-11-12-33-29-25(21)18-24(37-3)19-28(29)35-13-15-36(16-14-35)31-26-17-22(20-32)9-10-27(26)34(2)30(31)23-7-5-4-6-8-23/h9-12,17-19,23H,4-8,13-16H2,1-3H3