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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC(=C2C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC(=C2C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N)C

InChI

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