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

Systemtic Name: [3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [3,5-dimethyl-4-(p-tolylsulfanyl)pyrazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [3,5-dimethyl-4-[(4-methylphenyl)thio]-1-pyrazolyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [3,5-dimethyl-4-(p-tolylthio)pyrazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4S/c1-13-7-9-17(10-8-13)29-21-14(2)23-24(15(21)3)22(25)16-11-18(26-4)20(28-6)19(12-16)27-5/h7-12H,1-6H3