3-(1H-indol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]-3-thiophen-3-yl-propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]-3-thiophen-3-yl-propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[4-(o-tolyl)piperazin-1-yl]-3-(3-thienyl)propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[4-(2-methylphenyl)-1-piperazinyl]-3-(3-thiophenyl)-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]-3-thiophen-3-ylpropan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[4-(o-tolyl)piperazino]-3-(3-thienyl)propan-1-one Formula: C26H27N3OS MolecularWeight: 429.57708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CSC=C3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CSC=C3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H27N3OS/c1-19-6-2-5-9-25(19)28-11-13-29(14-12-28)26(30)16-22(20-10-15-31-18-20)23-17-27-24-8-4-3-7-21(23)24/h2-10,15,17-18,22,27H,11-14,16H2,1H3