(E)-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-3-phenylsulfanyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-3-phenylsulfanyl-prop-2-en-1-one Openeye Name: (E)-1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]-3-phenylsulfanyl-prop-2-en-1-one CAS Name: (E)-1-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-3-(phenylthio)-2-propen-1-one IUPAC Name: (E)-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-3-phenylsulfanylprop-2-en-1-one Traditional Name: (E)-1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]-3-(phenylthio)prop-2-en-1-one Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)C=CSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)/C=C/SC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O4S2/c1-14-18(15(2)25-19-14)27(23,24)21-11-9-20(10-12-21)17(22)8-13-26-16-6-4-3-5-7-16/h3-8,13H,9-12H2,1-2H3/b13-8+