methyl (E)-3-(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)-3-methylsulfanyl-2-phenyl-prop-2-enedithioate

Systemtic Name: methyl (E)-3-(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)-3-methylsulfanyl-2-phenyl-prop-2-enedithioate Openeye Name: methyl (E)-3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-methylsulfanyl-2-phenyl-prop-2-enedithioate CAS Name: (E)-3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-(methylthio)-2-phenyl-2-propenedithioic acid methyl ester IUPAC Name: methyl (E)-3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-methylsulfanyl-2-phenylprop-2-enedithioate Traditional Name: (E)-3-(2-keto-3-methyl-1,3-benzoxazol-6-yl)-3-(methylthio)-2-phenyl-prop-2-enedithioic acid methyl ester Formula: C19H17NO2S3 MolecularWeight: 387.53878

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=C(C3=CC=CC=C3)C(=S)SC)SC)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)/C(=C(/C3=CC=CC=C3)\C(=S)SC)/SC)OC1=O

InChI

InChI=1S/C19H17NO2S3/c1-20-14-10-9-13(11-15(14)22-19(20)21)17(24-2)16(18(23)25-3)12-7-5-4-6-8-12/h4-11H,1-3H3/b17-16+