ethyl 5-azanyl-1-[4-[[2-(phenylcarbonyl)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[[2-(phenylcarbonyl)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(2-benzoylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[(2-benzoylanilino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(2-benzoylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(2-benzoylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C26H22N4O4 MolecularWeight: 454.47728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C26H22N4O4/c1-2-34-26(33)21-16-28-30(24(21)27)19-14-12-18(13-15-19)25(32)29-22-11-7-6-10-20(22)23(31)17-8-4-3-5-9-17/h3-16H,2,27H2,1H3,(H,29,32)