(5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) 2-ethoxynaphthalene-1-carboxylate

Systemtic Name: (5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) 2-ethoxynaphthalene-1-carboxylate Openeye Name: (5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) 2-ethoxynaphthalene-1-carboxylate CAS Name: 2-ethoxy-1-naphthalenecarboxylic acid [5-methyl-2-phenyl-4-(phenylthio)-3-pyrazolyl] ester IUPAC Name: (5-methyl-2-phenyl-4-phenylsulfanylpyrazol-3-yl) 2-ethoxynaphthalene-1-carboxylate Traditional Name: 2-ethoxynaphthalene-1-carboxylic acid [5-methyl-2-phenyl-4-(phenylthio)pyrazol-3-yl] ester Formula: C29H24N2O3S MolecularWeight: 480.57746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)OC3=C(C(=NN3C4=CC=CC=C4)C)SC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)OC3=C(C(=NN3C4=CC=CC=C4)C)SC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O3S/c1-3-33-25-19-18-21-12-10-11-17-24(21)26(25)29(32)34-28-27(35-23-15-8-5-9-16-23)20(2)30-31(28)22-13-6-4-7-14-22/h4-19H,3H2,1-2H3