[4-(4-chlorophenyl)sulfanyl-5-methyl-2-phenyl-pyrazol-3-yl] naphthalene-1-carboxylate

Systemtic Name: [4-(4-chlorophenyl)sulfanyl-5-methyl-2-phenyl-pyrazol-3-yl] naphthalene-1-carboxylate Openeye Name: [4-(4-chlorophenyl)sulfanyl-5-methyl-2-phenyl-pyrazol-3-yl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [4-[(4-chlorophenyl)thio]-5-methyl-2-phenyl-3-pyrazolyl] ester IUPAC Name: [4-(4-chlorophenyl)sulfanyl-5-methyl-2-phenylpyrazol-3-yl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [4-[(4-chlorophenyl)thio]-5-methyl-2-phenyl-pyrazol-3-yl] ester Formula: C27H19ClN2O2S MolecularWeight: 470.96996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=C(C=C2)Cl)OC(=O)C3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=C(C=C2)Cl)OC(=O)C3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H19ClN2O2S/c1-18-25(33-22-16-14-20(28)15-17-22)26(30(29-18)21-10-3-2-4-11-21)32-27(31)24-13-7-9-19-8-5-6-12-23(19)24/h2-17H,1H3