3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(4-chlorophenyl)carbamoyl]benzamide

Systemtic Name: 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(4-chlorophenyl)carbamoyl]benzamide Openeye Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(4-chlorophenyl)carbamoyl]benzamide CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[(4-chloroanilino)-oxomethyl]benzamide IUPAC Name: 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[(4-chlorophenyl)carbamoyl]benzamide Traditional Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(4-chlorophenyl)carbamoyl]benzamide Formula: C20H18BrClN4O2 MolecularWeight: 461.73952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC(=O)NC3=CC=C(C=C3)Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC(=O)NC3=CC=C(C=C3)Cl)C)Br

InChI

InChI=1S/C20H18BrClN4O2/c1-12-18(21)13(2)26(25-12)11-14-4-3-5-15(10-14)19(27)24-20(28)23-17-8-6-16(22)7-9-17/h3-10H,11H2,1-2H3,(H2,23,24,27,28)