1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanone

Systemtic Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanone Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[3-(p-tolylsulfonyl)indol-1-yl]ethanone CAS Name: 1-[4-(2-methoxyphenyl)-1-piperazinyl]-2-[3-(4-methylphenyl)sulfonyl-1-indolyl]ethanone IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanone Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-2-(3-tosylindol-1-yl)ethanone Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C28H29N3O4S/c1-21-11-13-22(14-12-21)36(33,34)27-19-31(24-8-4-3-7-23(24)27)20-28(32)30-17-15-29(16-18-30)25-9-5-6-10-26(25)35-2/h3-14,19H,15-18,20H2,1-2H3