methyl 5-azanyl-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[(2,3-dimethylanilino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N)C

InChI

InChI=1S/C20H20N4O3/c1-12-5-4-6-17(13(12)2)23-19(25)14-7-9-15(10-8-14)24-18(21)16(11-22-24)20(26)27-3/h4-11H,21H2,1-3H3,(H,23,25)