4-[(8-chloranyl-5-methyl-4-oxidanylidene-2,3-dihydrothiochromen-6-yl)carbonyl]-2-ethyl-1H-pyrazol-3-one

Systemtic Name: 4-[(8-chloranyl-5-methyl-4-oxidanylidene-2,3-dihydrothiochromen-6-yl)carbonyl]-2-ethyl-1H-pyrazol-3-one Openeye Name: 4-(8-chloro-5-methyl-4-oxo-thiochromane-6-carbonyl)-2-ethyl-1H-pyrazol-3-one CAS Name: 4-[(8-chloro-5-methyl-4-oxo-2,3-dihydro-1-benzothiopyran-6-yl)-oxomethyl]-2-ethyl-1H-pyrazol-3-one IUPAC Name: 4-(8-chloro-5-methyl-4-oxo-2,3-dihydrothiochromene-6-carbonyl)-2-ethyl-1H-pyrazol-3-one Traditional Name: 4-(8-chloro-4-keto-5-methyl-thiochroman-6-carbonyl)-2-ethyl-3-pyrazolin-3-one Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CN1)C(=O)C2=CC(=C3C(=C2C)C(=O)CCS3)Cl

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=CC(=C3C(=C2C)C(=O)CCS3)Cl

InChI

InChI=1S/C16H15ClN2O3S/c1-3-19-16(22)10(7-18-19)14(21)9-6-11(17)15-13(8(9)2)12(20)4-5-23-15/h6-7,18H,3-5H2,1-2H3