ethyl 5-(4-bromophenyl)-1-[4-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(4-bromophenyl)-1-[4-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-(4-bromophenyl)-1-[4-(m-tolylmethylcarbamoyl)phenyl]pyrazole-3-carboxylate CAS Name: 5-(4-bromophenyl)-1-[4-[[(3-methylphenyl)methylamino]-oxomethyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-bromophenyl)-1-[4-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrazole-3-carboxylate Traditional Name: 5-(4-bromophenyl)-1-[4-[(3-methylbenzyl)carbamoyl]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C27H24BrN3O3 MolecularWeight: 518.40176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(=O)NCC4=CC=CC(=C4)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(=O)NCC4=CC=CC(=C4)C

InChI

InChI=1S/C27H24BrN3O3/c1-3-34-27(33)24-16-25(20-7-11-22(28)12-8-20)31(30-24)23-13-9-21(10-14-23)26(32)29-17-19-6-4-5-18(2)15-19/h4-16H,3,17H2,1-2H3,(H,29,32)