4-[[4-(4-methyl-3-pyrrol-1-yl-phenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4-methyl-3-pyrrol-1-yl-phenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4-methyl-3-pyrrol-1-yl-benzoyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[4-methyl-3-(1-pyrrolyl)phenyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4-methyl-3-pyrrol-1-ylbenzoyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(4-methyl-3-pyrrol-1-yl-benzoyl)piperazino]methyl]benzonitrile Formula: C24H24N4O MolecularWeight: 384.47356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)N4C=CC=C4

InChI

InChI=1S/C24H24N4O/c1-19-4-9-22(16-23(19)27-10-2-3-11-27)24(29)28-14-12-26(13-15-28)18-21-7-5-20(17-25)6-8-21/h2-11,16H,12-15,18H2,1H3