N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-[[3,5-dimethyl-1-(2-methylphenyl)-4-pyrazolyl]methyl]-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]-4-keto-4-[4-(methylthio)phenyl]butyramide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=O)CCC(=O)C3=CC=C(C=C3)SC)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=O)CCC(=O)C3=CC=C(C=C3)SC)C

InChI

InChI=1S/C24H27N3O2S/c1-16-7-5-6-8-22(16)27-18(3)21(17(2)26-27)15-25-24(29)14-13-23(28)19-9-11-20(30-4)12-10-19/h5-12H,13-15H2,1-4H3,(H,25,29)