1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-2-(2-methylphenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-2-(2-methylphenyl)sulfanyl-ethanone Openeye Name: 1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]-2-(o-tolylsulfanyl)ethanone CAS Name: 1-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-2-[(2-methylphenyl)thio]ethanone IUPAC Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-2-(2-methylphenyl)sulfanylethanone Traditional Name: 1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]-2-(o-tolylthio)ethanone Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C18H23N3O4S2/c1-13-6-4-5-7-16(13)26-12-17(22)20-8-10-21(11-9-20)27(23,24)18-14(2)19-25-15(18)3/h4-7H,8-12H2,1-3H3