4-[[(4Z)-5,8-dimethyl-1,1-bis(oxidanylidene)-4-propan-2-yloxyimino-2,3-dihydrothiochromen-6-yl]carbonyl]-2-ethyl-1H-pyrazol-3-one

Systemtic Name: 4-[[(4Z)-5,8-dimethyl-1,1-bis(oxidanylidene)-4-propan-2-yloxyimino-2,3-dihydrothiochromen-6-yl]carbonyl]-2-ethyl-1H-pyrazol-3-one Openeye Name: 2-ethyl-4-[(4Z)-4-isopropoxyimino-5,8-dimethyl-1,1-dioxo-2,3-dihydrothiochromene-6-carbonyl]-1H-pyrazol-3-one CAS Name: 4-[[(4Z)-5,8-dimethyl-1,1-dioxo-4-propan-2-yloxyimino-2,3-dihydro-1-benzothiopyran-6-yl]-oxomethyl]-2-ethyl-1H-pyrazol-3-one IUPAC Name: 4-[(4Z)-5,8-dimethyl-1,1-dioxo-4-propan-2-yloxyimino-2,3-dihydrothiochromene-6-carbonyl]-2-ethyl-1H-pyrazol-3-one Traditional Name: 2-ethyl-4-[(4Z)-4-isopropyloximino-1,1-diketo-5,8-dimethyl-2,3-dihydrothiochromene-6-carbonyl]-3-pyrazolin-3-one Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=CC(=C3C(=C2C)/C(=N\OC(C)C)/CCS3(=O)=O)C

InChI

InChI=1S/C20H25N3O5S/c1-6-23-20(25)15(10-21-23)18(24)14-9-12(4)19-17(13(14)5)16(22-28-11(2)3)7-8-29(19,26)27/h9-11,21H,6-8H2,1-5H3/b22-16-