5-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one CAS Name: 5-[[(4-chlorophenyl)thio]methyl]-4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-[[(4-chlorophenyl)thio]methyl]-4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-3-pyrazolin-3-one Formula: C23H17ClN2O2S MolecularWeight: 420.91128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(N2)CSC3=CC=C(C=C3)Cl)C=C4C=CC(=O)C=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(N2)CSC3=CC=C(C=C3)Cl)C=C4C=CC(=O)C=C4

InChI

InChI=1S/C23H17ClN2O2S/c24-17-8-12-20(13-9-17)29-15-22-21(14-16-6-10-19(27)11-7-16)23(28)26(25-22)18-4-2-1-3-5-18/h1-14,25H,15H2