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

Systemtic Name: [3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]-(4-ethoxyphenyl)methanone Openeye Name: [3,5-dimethyl-4-(p-tolylsulfanyl)pyrazol-1-yl]-(4-ethoxyphenyl)methanone CAS Name: [3,5-dimethyl-4-[(4-methylphenyl)thio]-1-pyrazolyl]-(4-ethoxyphenyl)methanone IUPAC Name: [3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-(4-ethoxyphenyl)methanone Traditional Name: [3,5-dimethyl-4-(p-tolylthio)pyrazol-1-yl]-p-phenetyl-methanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N2C(=C(C(=N2)C)SC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N2C(=C(C(=N2)C)SC3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H22N2O2S/c1-5-25-18-10-8-17(9-11-18)21(24)23-16(4)20(15(3)22-23)26-19-12-6-14(2)7-13-19/h6-13H,5H2,1-4H3