2-(4-ethylsulfonylphenyl)-5-methyl-4-[(2E)-2-(3-methylsulfonyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-1H-pyrazol-3-one

Systemtic Name: 2-(4-ethylsulfonylphenyl)-5-methyl-4-[(2E)-2-(3-methylsulfonyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-1H-pyrazol-3-one Openeye Name: 2-(4-ethylsulfonylphenyl)-5-methyl-4-[(2E)-2-(3-methylsulfonyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]-1H-pyrazol-3-one CAS Name: 2-(4-ethylsulfonylphenyl)-5-methyl-4-[(2E)-2-(3-methylsulfonyl-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]-1H-pyrazol-3-one IUPAC Name: 2-(4-ethylsulfonylphenyl)-5-methyl-4-[(2E)-2-(3-methylsulfonyl-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-1H-pyrazol-3-one Traditional Name: 2-(4-esylphenyl)-4-[(N'E)-N'-(6-keto-3-mesyl-cyclohexa-2,4-dien-1-ylidene)hydrazino]-5-methyl-3-pyrazolin-3-one Formula: C19H20N4O6S2 MolecularWeight: 464.5153

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)N2C(=O)C(=C(N2)C)NN=C3C=C(C=CC3=O)S(=O)(=O)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)N2C(=O)C(=C(N2)C)N/N=C/3\C=C(C=CC3=O)S(=O)(=O)C

InChI

InChI=1S/C19H20N4O6S2/c1-4-31(28,29)14-7-5-13(6-8-14)23-19(25)18(12(2)22-23)21-20-16-11-15(30(3,26)27)9-10-17(16)24/h5-11,21-22H,4H2,1-3H3/b20-16+