N-(4-bromanyl-3-methyl-phenyl)-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(1,2,4-triazol-1-yl)benzamide Formula: C16H13BrN4O MolecularWeight: 357.20462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N3C=NC=N3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N3C=NC=N3)Br

InChI

InChI=1S/C16H13BrN4O/c1-11-8-13(4-7-15(11)17)20-16(22)12-2-5-14(6-3-12)21-10-18-9-19-21/h2-10H,1H3,(H,20,22)