4-[[(4E)-4-ethoxyimino-8-methylsulfanyl-2,3-dihydrochromen-7-yl]carbonyl]-2,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: 4-[[(4E)-4-ethoxyimino-8-methylsulfanyl-2,3-dihydrochromen-7-yl]carbonyl]-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: 4-[(4E)-4-ethoxyimino-8-methylsulfanyl-chromane-7-carbonyl]-2,5-dimethyl-1H-pyrazol-3-one CAS Name: 4-[[(4E)-4-ethoxyimino-8-(methylthio)-3,4-dihydro-2H-1-benzopyran-7-yl]-oxomethyl]-2,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 4-[(4E)-4-ethoxyimino-8-methylsulfanyl-2,3-dihydrochromene-7-carbonyl]-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: 4-[(4E)-4-ethyloximino-8-(methylthio)chroman-7-carbonyl]-2,5-dimethyl-3-pyrazolin-3-one Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C1CCOC2=C1C=CC(=C2SC)C(=O)C3=C(NN(C3=O)C)C

Isomeric SMILES

CCO/N=C/1\CCOC2=C1C=CC(=C2SC)C(=O)C3=C(NN(C3=O)C)C

InChI

InChI=1S/C18H21N3O4S/c1-5-25-20-13-8-9-24-16-11(13)6-7-12(17(16)26-4)15(22)14-10(2)19-21(3)18(14)23/h6-7,19H,5,8-9H2,1-4H3/b20-13+