ethyl 5-[(4-bromophenyl)carbonylamino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-bromophenyl)carbonylamino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-bromobenzoyl)amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[(4-bromophenyl)-oxomethyl]amino]-1-(4-methyl-2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-bromobenzoyl)amino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate Traditional Name: 5-[(4-bromobenzoyl)amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C23H19BrN4O3 MolecularWeight: 479.32596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19BrN4O3/c1-3-31-23(30)18-13-25-28(20-12-14(2)17-6-4-5-7-19(17)26-20)21(18)27-22(29)15-8-10-16(24)11-9-15/h4-13H,3H2,1-2H3,(H,27,29)