ethyl 3-phenyl-5-phenylsulfanyl-pyrazole-1-carboxylate

Systemtic Name: ethyl 3-phenyl-5-phenylsulfanyl-pyrazole-1-carboxylate Openeye Name: ethyl 3-phenyl-5-phenylsulfanyl-pyrazole-1-carboxylate CAS Name: 3-phenyl-5-(phenylthio)-1-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-phenyl-5-phenylsulfanylpyrazole-1-carboxylate Traditional Name: 3-phenyl-5-(phenylthio)pyrazole-1-carboxylic acid ethyl ester Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=CC(=N1)C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1C(=CC(=N1)C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S/c1-2-22-18(21)20-17(23-15-11-7-4-8-12-15)13-16(19-20)14-9-5-3-6-10-14/h3-13H,2H2,1H3