2-(4-ethanoylpiperazin-1-yl)carbonyl-1-(4-ethylphenyl)pyrrole-3-carbonitrile

Systemtic Name: 2-(4-ethanoylpiperazin-1-yl)carbonyl-1-(4-ethylphenyl)pyrrole-3-carbonitrile Openeye Name: 2-(4-acetylpiperazine-1-carbonyl)-1-(4-ethylphenyl)pyrrole-3-carbonitrile CAS Name: 2-[(4-acetyl-1-piperazinyl)-oxomethyl]-1-(4-ethylphenyl)-3-pyrrolecarbonitrile IUPAC Name: 2-(4-acetylpiperazine-1-carbonyl)-1-(4-ethylphenyl)pyrrole-3-carbonitrile Traditional Name: 2-(4-acetylpiperazine-1-carbonyl)-1-(4-ethylphenyl)pyrrole-3-carbonitrile Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2/c1-3-16-4-6-18(7-5-16)24-9-8-17(14-21)19(24)20(26)23-12-10-22(11-13-23)15(2)25/h4-9H,3,10-13H2,1-2H3