N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C17H15BrF3N5O MolecularWeight: 442.23311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)NC(=O)C3=NN(C(=C3)C(F)(F)F)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)NC(=O)C3=NN(C(=C3)C(F)(F)F)C)Br

InChI

InChI=1S/C17H15BrF3N5O/c1-10-3-5-11(6-4-10)8-26-9-12(18)15(24-26)22-16(27)13-7-14(17(19,20)21)25(2)23-13/h3-7,9H,8H2,1-2H3,(H,22,24,27)