(5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) ethanoate

Systemtic Name: (5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) ethanoate Openeye Name: (5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) acetate CAS Name: acetic acid [5-methyl-2-phenyl-4-(phenylthio)-3-pyrazolyl] ester IUPAC Name: (5-methyl-2-phenyl-4-phenylsulfanylpyrazol-3-yl) acetate Traditional Name: acetic acid [5-methyl-2-phenyl-4-(phenylthio)pyrazol-3-yl] ester Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S/c1-13-17(23-16-11-7-4-8-12-16)18(22-14(2)21)20(19-13)15-9-5-3-6-10-15/h3-12H,1-2H3