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

Systemtic Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]ethanone Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C18H23N3O4S2/c1-14-18(15(2)25-19-14)27(23,24)21-10-8-20(9-11-21)17(22)13-26-12-16-6-4-3-5-7-16/h3-7H,8-13H2,1-2H3