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

Systemtic Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(m-tolyl)pyrrole-3-carbonyl]piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-[[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrole-3-carbonyl]piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(m-tolyl)pyrrole-3-carbonyl]piperazino]-2-(2-thienyl)ethanone Formula: C29H28ClN3O2S MolecularWeight: 518.06952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=C2C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)CC5=CC=CS5)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=C2C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)CC5=CC=CS5)C

InChI

InChI=1S/C29H28ClN3O2S/c1-20-5-3-6-24(17-20)33-21(2)26(19-27(33)22-8-10-23(30)11-9-22)29(35)32-14-12-31(13-15-32)28(34)18-25-7-4-16-36-25/h3-11,16-17,19H,12-15,18H2,1-2H3