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

Systemtic Name: [3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [3,5-dimethyl-4-(p-tolylsulfanyl)pyrazol-1-yl]-(3-pyridyl)methanone CAS Name: [3,5-dimethyl-4-[(4-methylphenyl)thio]-1-pyrazolyl]-(3-pyridinyl)methanone IUPAC Name: [3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [3,5-dimethyl-4-(p-tolylthio)pyrazol-1-yl]-(3-pyridyl)methanone Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3OS/c1-12-6-8-16(9-7-12)23-17-13(2)20-21(14(17)3)18(22)15-5-4-10-19-11-15/h4-11H,1-3H3