N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-N,3,5-trimethyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-N,3,5-trimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-N,3,5-trimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-N,3,5-trimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-N,3,5-trimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-N,3,5-trimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N(C)CC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N(C)CC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C21H21BrN4O2/c1-14-20(15(2)26(24-14)16-9-5-4-6-10-16)21(28)25(3)13-19(27)23-18-12-8-7-11-17(18)22/h4-12H,13H2,1-3H3,(H,23,27)