ethyl 3-benzamido-5-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-(4-methylphenyl)pyrazine-2-carboxylate

Systemtic Name: ethyl 3-benzamido-5-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-(4-methylphenyl)pyrazine-2-carboxylate Openeye Name: ethyl 3-benzamido-5-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-6-(p-tolyl)pyrazine-2-carboxylate CAS Name: 3-benzamido-5-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-6-(4-methylphenyl)-2-pyrazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzamido-5-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-(4-methylphenyl)pyrazine-2-carboxylate Traditional Name: 3-benzamido-5-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-6-(p-tolyl)pyrazinic acid ethyl ester Formula: C32H29N5O4 MolecularWeight: 547.60376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=C(N=C1NC(=O)C2=CC=CC=C2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=NC(=C(N=C1NC(=O)C2=CC=CC=C2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=CC=C(C=C5)C

InChI

InChI=1S/C32H29N5O4/c1-5-41-32(40)28-29(35-30(38)23-12-8-6-9-13-23)34-27(26(33-28)22-18-16-20(2)17-19-22)25-21(3)36(4)37(31(25)39)24-14-10-7-11-15-24/h6-19H,5H2,1-4H3,(H,34,35,38)