S-(1,3-benzothiazol-2-yl) (2E)-4-chloranyl-2-methoxyimino-3-oxidanylidene-butanethioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) (2E)-4-chloranyl-2-methoxyimino-3-oxidanylidene-butanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) (2E)-4-chloro-2-methoxyimino-3-oxo-butanethioate CAS Name: (2E)-4-chloro-2-methoxyimino-3-oxobutanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) (2E)-4-chloro-2-methoxyimino-3-oxobutanethioate Traditional Name: (2E)-4-chloro-3-keto-2-methyloximino-butanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C12H9ClN2O3S2 MolecularWeight: 328.79446

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C(=O)CCl)C(=O)SC1=NC2=CC=CC=C2S1

Isomeric SMILES

CO/N=C(\C(=O)CCl)/C(=O)SC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H9ClN2O3S2/c1-18-15-10(8(16)6-13)11(17)20-12-14-7-4-2-3-5-9(7)19-12/h2-5H,6H2,1H3/b15-10+