3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]-3-thiophen-3-yl-propan-1-one

Systemtic Name: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]-3-thiophen-3-yl-propan-1-one Openeye Name: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(o-tolyl)piperazin-1-yl]-3-(3-thienyl)propan-1-one CAS Name: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methylphenyl)-1-piperazinyl]-3-(3-thiophenyl)-1-propanone IUPAC Name: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]-3-thiophen-3-ylpropan-1-one Traditional Name: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(o-tolyl)piperazino]-3-(3-thienyl)propan-1-one Formula: C28H31N3OS MolecularWeight: 457.63024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)N3CCN(CC3)C4=CC=CC=C4C)C5=CSC=C5

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC(=O)N3CCN(CC3)C4=CC=CC=C4C)C5=CSC=C5

InChI

InChI=1S/C28H31N3OS/c1-3-21-8-6-9-23-25(18-29-28(21)23)24(22-11-16-33-19-22)17-27(32)31-14-12-30(13-15-31)26-10-5-4-7-20(26)2/h4-11,16,18-19,24,29H,3,12-15,17H2,1-2H3