3-[[5-(4-cyclopentylpiperazin-1-yl)carbonylindol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[5-(4-cyclopentylpiperazin-1-yl)carbonylindol-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[5-(4-cyclopentylpiperazine-1-carbonyl)indol-1-yl]methyl]benzonitrile CAS Name: 3-[[5-[(4-cyclopentyl-1-piperazinyl)-oxomethyl]-1-indolyl]methyl]benzonitrile IUPAC Name: 3-[[5-(4-cyclopentylpiperazine-1-carbonyl)indol-1-yl]methyl]benzonitrile Traditional Name: 3-[[5-(4-cyclopentylpiperazine-1-carbonyl)indol-1-yl]methyl]benzonitrile Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(C=C4)CC5=CC=CC(=C5)C#N

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(C=C4)CC5=CC=CC(=C5)C#N

InChI

InChI=1S/C26H28N4O/c27-18-20-4-3-5-21(16-20)19-30-11-10-22-17-23(8-9-25(22)30)26(31)29-14-12-28(13-15-29)24-6-1-2-7-24/h3-5,8-11,16-17,24H,1-2,6-7,12-15,19H2