(2-ethylpyrazol-3-yl) 4-chloranyl-5-methyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-6-carboxylate

Systemtic Name: (2-ethylpyrazol-3-yl) 4-chloranyl-5-methyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-6-carboxylate Openeye Name: (2-ethylpyrazol-3-yl) 4-chloro-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carboxylate CAS Name: 4-chloro-5-methyl-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-6-carboxylic acid (2-ethyl-3-pyrazolyl) ester IUPAC Name: (2-ethylpyrazol-3-yl) 4-chloro-5-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carboxylate Traditional Name: 4-chloro-1,1-diketo-5-methyl-3,4-dihydro-2H-thiochromene-6-carboxylic acid (2-ethylpyrazol-3-yl) ester Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)OC(=O)C2=C(C3=C(C=C2)S(=O)(=O)CCC3Cl)C

Isomeric SMILES

CCN1C(=CC=N1)OC(=O)C2=C(C3=C(C=C2)S(=O)(=O)CCC3Cl)C

InChI

InChI=1S/C16H17ClN2O4S/c1-3-19-14(6-8-18-19)23-16(20)11-4-5-13-15(10(11)2)12(17)7-9-24(13,21)22/h4-6,8,12H,3,7,9H2,1-2H3