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

Systemtic Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(o-tolyl)pyrrole-3-carbonyl]piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-[[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)pyrrole-3-carbonyl]piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(o-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=C1N2C(=C(C=C2C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)CC5=CC=CS5)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=C2C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)CC5=CC=CS5)C

InChI

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