2-[4-(3-methylphenyl)piperazin-1-yl]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(3-methylphenyl)piperazin-1-yl]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(m-tolyl)piperazin-1-yl]-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[4-(3-methylphenyl)-1-piperazinyl]-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(3-methylphenyl)piperazin-1-yl]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(m-tolyl)piperazino]-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H32N4O3S/c1-22-5-4-8-25(19-22)29-13-11-28(12-14-29)21-27(32)30-15-17-31(18-16-30)35(33,34)26-10-9-23-6-2-3-7-24(23)20-26/h2-10,19-20H,11-18,21H2,1H3