(4-methylsulfanylphenyl)methyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: (4-methylsulfanylphenyl)methyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: (4-methylsulfanylphenyl)methyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid [4-(methylthio)benzyl] ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OCC2=CC=C(C=C2)SC)C3=CC=CC=C3

Isomeric SMILES

COC1=CN(N=C1C(=O)OCC2=CC=C(C=C2)SC)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-23-17-12-21(15-6-4-3-5-7-15)20-18(17)19(22)24-13-14-8-10-16(25-2)11-9-14/h3-12H,13H2,1-2H3