1-(4-ethylphenyl)-2-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrole-3-carbonitrile

Systemtic Name: 1-(4-ethylphenyl)-2-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrole-3-carbonitrile Openeye Name: 1-(4-ethylphenyl)-2-[4-(o-tolyl)piperazine-1-carbonyl]pyrrole-3-carbonitrile CAS Name: 1-(4-ethylphenyl)-2-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-3-pyrrolecarbonitrile IUPAC Name: 1-(4-ethylphenyl)-2-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrole-3-carbonitrile Traditional Name: 1-(4-ethylphenyl)-2-[4-(o-tolyl)piperazine-1-carbonyl]pyrrole-3-carbonitrile Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C=CC(=C2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)N2C=CC(=C2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C#N

InChI

InChI=1S/C25H26N4O/c1-3-20-8-10-22(11-9-20)29-13-12-21(18-26)24(29)25(30)28-16-14-27(15-17-28)23-7-5-4-6-19(23)2/h4-13H,3,14-17H2,1-2H3