1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]butan-1-one

Systemtic Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]butan-1-one Openeye Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(m-tolyl)pyrrole-3-carbonyl]piperazin-1-yl]butan-1-one CAS Name: 1-[4-[[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrole-3-carbonyl]piperazin-1-yl]butan-1-one Traditional Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(m-tolyl)pyrrole-3-carbonyl]piperazino]butan-1-one Formula: C27H30ClN3O2 MolecularWeight: 463.999

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C)C

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C)C

InChI

InChI=1S/C27H30ClN3O2/c1-4-6-26(32)29-13-15-30(16-14-29)27(33)24-18-25(21-9-11-22(28)12-10-21)31(20(24)3)23-8-5-7-19(2)17-23/h5,7-12,17-18H,4,6,13-16H2,1-3H3