(2-ethylpyrazol-3-yl) (4E)-4-methoxyimino-5-methyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-6-carboxylate

Systemtic Name: (2-ethylpyrazol-3-yl) (4E)-4-methoxyimino-5-methyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-6-carboxylate Openeye Name: (2-ethylpyrazol-3-yl) (4E)-4-methoxyimino-5-methyl-1,1-dioxo-2,3-dihydrothiochromene-6-carboxylate CAS Name: (4E)-4-methoxyimino-5-methyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-6-carboxylic acid (2-ethyl-3-pyrazolyl) ester IUPAC Name: (2-ethylpyrazol-3-yl) (4E)-4-methoxyimino-5-methyl-1,1-dioxo-2,3-dihydrothiochromene-6-carboxylate Traditional Name: (4E)-1,1-diketo-5-methyl-4-methyloximino-2,3-dihydrothiochromene-6-carboxylic acid (2-ethylpyrazol-3-yl) ester Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)OC(=O)C2=C(C3=C(C=C2)S(=O)(=O)CCC3=NOC)C

Isomeric SMILES

CCN1C(=CC=N1)OC(=O)C2=C(C\3=C(C=C2)S(=O)(=O)CC/C3=N\OC)C

InChI

InChI=1S/C17H19N3O5S/c1-4-20-15(7-9-18-20)25-17(21)12-5-6-14-16(11(12)2)13(19-24-3)8-10-26(14,22)23/h5-7,9H,4,8,10H2,1-3H3/b19-13+