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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-(1,2,4-triazol-1-yl)propionamide Formula: C12H13BrN4O MolecularWeight: 309.16182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)N2C=NC=N2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)N2C=NC=N2)Br

InChI

InChI=1S/C12H13BrN4O/c1-8-3-4-11(10(13)5-8)16-12(18)9(2)17-7-14-6-15-17/h3-7,9H,1-2H3,(H,16,18)