ethyl 2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-4-phenyl-3H-pyrazole-4-carboxylate

Systemtic Name: ethyl 2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-4-phenyl-3H-pyrazole-4-carboxylate Openeye Name: ethyl 2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-4-phenyl-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-bromoanilino)-oxomethyl]-5-(4-chlorophenyl)-4-phenyl-3H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-4-phenyl-3H-pyrazole-4-carboxylate Traditional Name: 1-[(4-bromophenyl)carbamoyl]-3-(4-chlorophenyl)-4-phenyl-2-pyrazoline-4-carboxylic acid ethyl ester Formula: C25H21BrClN3O3 MolecularWeight: 526.80954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C25H21BrClN3O3/c1-2-33-23(31)25(18-6-4-3-5-7-18)16-30(24(32)28-21-14-10-19(26)11-15-21)29-22(25)17-8-12-20(27)13-9-17/h3-15H,2,16H2,1H3,(H,28,32)