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

Systemtic Name: methyl 2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-4-phenyl-3H-pyrazole-4-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C24H19BrClN3O3 MolecularWeight: 512.78296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=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/C24H19BrClN3O3/c1-32-22(30)24(17-5-3-2-4-6-17)15-29(23(31)27-20-13-9-18(25)10-14-20)28-21(24)16-7-11-19(26)12-8-16/h2-14H,15H2,1H3,(H,27,31)