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

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-(4-ethylphenyl)pyrrole-3-carbonitrile Openeye Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-(4-ethylphenyl)pyrrole-3-carbonitrile CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-(4-ethylphenyl)-3-pyrrolecarbonitrile IUPAC Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-(4-ethylphenyl)pyrrole-3-carbonitrile Traditional Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-(4-ethylphenyl)pyrrole-3-carbonitrile Formula: C24H23ClN4O MolecularWeight: 418.91862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23ClN4O/c1-2-18-6-8-21(9-7-18)29-11-10-19(17-26)23(29)24(30)28-14-12-27(13-15-28)22-5-3-4-20(25)16-22/h3-11,16H,2,12-15H2,1H3