2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-1-(4-mesylpiperazino)ethanone Formula: C13H21N3O4S2 MolecularWeight: 347.45354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H21N3O4S2/c1-10-12(11(2)20-14-10)8-21-9-13(17)15-4-6-16(7-5-15)22(3,18)19/h4-9H2,1-3H3