4-bromanyl-2,5-dimethyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2,5-dimethyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]pyrazole-3-carboxamide Openeye Name: 4-bromo-2,5-dimethyl-N-[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]pyrazole-3-carboxamide CAS Name: 4-bromo-2,5-dimethyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2,5-dimethyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]pyrazole-3-carboxamide Traditional Name: 4-bromo-2,5-dimethyl-N-[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]pyrazole-3-carboxamide Formula: C16H17BrN6O MolecularWeight: 389.24978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)C3=C(C(=NN3C)C)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)C3=C(C(=NN3C)C)Br

InChI

InChI=1S/C16H17BrN6O/c1-10-5-4-6-12(7-10)8-23-9-18-16(21-23)19-15(24)14-13(17)11(2)20-22(14)3/h4-7,9H,8H2,1-3H3,(H,19,21,24)