2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]acetamide CAS Name: 2-(4-bromo-5-methyl-1-pyrazolyl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide IUPAC Name: 2-(4-bromo-5-methylpyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]acetamide Formula: C16H17BrN6O MolecularWeight: 389.24978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)CN3C(=C(C=N3)Br)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)CN3C(=C(C=N3)Br)C

InChI

InChI=1S/C16H17BrN6O/c1-11-4-3-5-13(6-11)8-22-10-18-16(21-22)20-15(24)9-23-12(2)14(17)7-19-23/h3-7,10H,8-9H2,1-2H3,(H,20,21,24)