4-[[4-[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[1-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[1-(1H-indol-3-yl)-1-oxopropan-2-yl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]piperazino]methyl]benzonitrile Formula: C23H24N4O MolecularWeight: 372.46286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H24N4O/c1-17(23(28)21-15-25-22-5-3-2-4-20(21)22)27-12-10-26(11-13-27)16-19-8-6-18(14-24)7-9-19/h2-9,15,17,25H,10-13,16H2,1H3