[2-[3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]carbonylphenyl]-phenyl-methanone

Systemtic Name: [2-[3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]carbonylphenyl]-phenyl-methanone Openeye Name: [2-[3,5-dimethyl-4-(p-tolylsulfanyl)pyrazole-1-carbonyl]phenyl]-phenyl-methanone CAS Name: [2-[[3,5-dimethyl-4-[(4-methylphenyl)thio]-1-pyrazolyl]-oxomethyl]phenyl]-phenylmethanone IUPAC Name: [2-[3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazole-1-carbonyl]phenyl]-phenylmethanone Traditional Name: [2-[3,5-dimethyl-4-(p-tolylthio)pyrazole-1-carbonyl]phenyl]-phenyl-methanone Formula: C26H22N2O2S MolecularWeight: 426.53008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(=O)C3=CC=CC=C3C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(=O)C3=CC=CC=C3C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H22N2O2S/c1-17-13-15-21(16-14-17)31-25-18(2)27-28(19(25)3)26(30)23-12-8-7-11-22(23)24(29)20-9-5-4-6-10-20/h4-16H,1-3H3