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

Systemtic Name: ethyl 5-azanyl-1-[4-[(2-chlorophenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(2-chlorophenyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[(2-chloroanilino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(2-chlorophenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(2-chlorophenyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H17ClN4O3 MolecularWeight: 384.81628

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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=C3Cl)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3Cl)N

InChI

InChI=1S/C19H17ClN4O3/c1-2-27-19(26)14-11-22-24(17(14)21)13-9-7-12(8-10-13)18(25)23-16-6-4-3-5-15(16)20/h3-11H,2,21H2,1H3,(H,23,25)