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

Systemtic Name: methyl 2-[(4-bromophenyl)carbamoyl]-5-(4-fluorophenyl)-4-methyl-3H-pyrazole-4-carboxylate Openeye Name: methyl 2-[(4-bromophenyl)carbamoyl]-5-(4-fluorophenyl)-4-methyl-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-bromoanilino)-oxomethyl]-5-(4-fluorophenyl)-4-methyl-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-bromophenyl)carbamoyl]-5-(4-fluorophenyl)-4-methyl-3H-pyrazole-4-carboxylate Traditional Name: 1-[(4-bromophenyl)carbamoyl]-3-(4-fluorophenyl)-4-methyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C19H17BrFN3O3 MolecularWeight: 434.258983

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC1(CN(N=C1C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C19H17BrFN3O3/c1-19(17(25)27-2)11-24(18(26)22-15-9-5-13(20)6-10-15)23-16(19)12-3-7-14(21)8-4-12/h3-10H,11H2,1-2H3,(H,22,26)