4-(4-ethylphenyl)sulfanyl-5-oxidanyl-1,2-diphenyl-pyrazol-3-one

Systemtic Name: 4-(4-ethylphenyl)sulfanyl-5-oxidanyl-1,2-diphenyl-pyrazol-3-one Openeye Name: 4-(4-ethylphenyl)sulfanyl-5-hydroxy-1,2-diphenyl-pyrazol-3-one CAS Name: 4-[(4-ethylphenyl)thio]-5-hydroxy-1,2-diphenyl-3-pyrazolone IUPAC Name: 4-(4-ethylphenyl)sulfanyl-5-hydroxy-1,2-diphenylpyrazol-3-one Traditional Name: 4-[(4-ethylphenyl)thio]-5-hydroxy-1,2-diphenyl-3-pyrazolin-3-one Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)SC2=C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCC1=CC=C(C=C1)SC2=C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C23H20N2O2S/c1-2-17-13-15-20(16-14-17)28-21-22(26)24(18-9-5-3-6-10-18)25(23(21)27)19-11-7-4-8-12-19/h3-16,26H,2H2,1H3