methyl 1-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-5-azanyl-pyrazole-4-carboxylate

Systemtic Name: methyl 1-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-5-azanyl-pyrazole-4-carboxylate Openeye Name: methyl 1-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-5-amino-pyrazole-4-carboxylate CAS Name: 1-[4-[(4-acetamidoanilino)-oxomethyl]phenyl]-5-amino-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-5-aminopyrazole-4-carboxylate Traditional Name: 1-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-5-amino-pyrazole-4-carboxylic acid methyl ester Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N

InChI

InChI=1S/C20H19N5O4/c1-12(26)23-14-5-7-15(8-6-14)24-19(27)13-3-9-16(10-4-13)25-18(21)17(11-22-25)20(28)29-2/h3-11H,21H2,1-2H3,(H,23,26)(H,24,27)