5-[(2-bromophenyl)carbonylamino]-N-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-[(2-bromophenyl)carbonylamino]-N-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-[(2-bromobenzoyl)amino]-N-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-[[(2-bromophenyl)-oxomethyl]amino]-N-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-[(2-bromobenzoyl)amino]-N-(3,4-dimethylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 5-[(2-bromobenzoyl)amino]-N-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C25H21BrN4O2 MolecularWeight: 489.36384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4Br)C

InChI

InChI=1S/C25H21BrN4O2/c1-16-12-13-18(14-17(16)2)28-25(32)21-15-27-30(19-8-4-3-5-9-19)23(21)29-24(31)20-10-6-7-11-22(20)26/h3-15H,1-2H3,(H,28,32)(H,29,31)