ethyl 1-[4-[[(2-bromophenyl)carbonylamino]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[[(2-bromophenyl)carbonylamino]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[[(2-bromobenzoyl)amino]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[[(2-bromophenyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[(2-bromobenzoyl)amino]carbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[[(2-bromobenzoyl)amino]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H19BrN4O4 MolecularWeight: 471.30396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3Br)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3Br)C

InChI

InChI=1S/C21H19BrN4O4/c1-3-30-21(29)17-12-23-26(13(17)2)15-10-8-14(9-11-15)19(27)24-25-20(28)16-6-4-5-7-18(16)22/h4-12H,3H2,1-2H3,(H,24,27)(H,25,28)