2-[2-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]-1-(4-tosylpiperazino)ethanone Formula: C22H26N2O4S3 MolecularWeight: 478.64784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC=C3C4SCCS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC=C3C4SCCS4

InChI

InChI=1S/C22H26N2O4S3/c1-17-6-8-18(9-7-17)31(26,27)24-12-10-23(11-13-24)21(25)16-28-20-5-3-2-4-19(20)22-29-14-15-30-22/h2-9,22H,10-16H2,1H3