1-ethyl-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]indole-5-carbonitrile

Systemtic Name: 1-ethyl-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]indole-5-carbonitrile Openeye Name: 1-ethyl-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]indole-5-carbonitrile CAS Name: 1-ethyl-3-[4-[4-(1H-indol-4-yl)-1-piperazinyl]cyclohexyl]-5-indolecarbonitrile IUPAC Name: 1-ethyl-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]indole-5-carbonitrile Traditional Name: 1-ethyl-3-[4-[4-(1H-indol-4-yl)piperazino]cyclohexyl]indole-5-carbonitrile Formula: C29H33N5 MolecularWeight: 451.60582

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)C#N)C3CCC(CC3)N4CCN(CC4)C5=CC=CC6=C5C=CN6

Isomeric SMILES

CCN1C=C(C2=C1C=CC(=C2)C#N)C3CCC(CC3)N4CCN(CC4)C5=CC=CC6=C5C=CN6

InChI

InChI=1S/C29H33N5/c1-2-32-20-26(25-18-21(19-30)6-11-29(25)32)22-7-9-23(10-8-22)33-14-16-34(17-15-33)28-5-3-4-27-24(28)12-13-31-27/h3-6,11-13,18,20,22-23,31H,2,7-10,14-17H2,1H3