[4-(2-methylphenyl)piperazin-1-yl]-[4-(4-methylphenyl)-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl]methanone

Systemtic Name: [4-(2-methylphenyl)piperazin-1-yl]-[4-(4-methylphenyl)-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl]methanone Openeye Name: [4-(o-tolyl)piperazin-1-yl]-[4-(p-tolyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]methanone CAS Name: [4-(4-methylphenyl)-1-[oxo(thiophen-2-yl)methyl]-3-pyrrolidinyl]-[4-(2-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-methylphenyl)piperazin-1-yl]-[4-(4-methylphenyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]methanone Traditional Name: [4-(o-tolyl)piperazino]-[4-(p-tolyl)-1-(2-thenoyl)pyrrolidin-3-yl]methanone Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C(=O)C5=CC=CS5

InChI

InChI=1S/C28H31N3O2S/c1-20-9-11-22(12-10-20)23-18-31(28(33)26-8-5-17-34-26)19-24(23)27(32)30-15-13-29(14-16-30)25-7-4-3-6-21(25)2/h3-12,17,23-24H,13-16,18-19H2,1-2H3