1-(3-azanyl-1,2,4-triazol-4-yl)-2-(4-bromanyl-2-methyl-phenoxy)ethanone

Systemtic Name: 1-(3-azanyl-1,2,4-triazol-4-yl)-2-(4-bromanyl-2-methyl-phenoxy)ethanone Openeye Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(4-bromo-2-methyl-phenoxy)ethanone CAS Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(4-bromo-2-methylphenoxy)ethanone IUPAC Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(4-bromo-2-methylphenoxy)ethanone Traditional Name: 1-(3-amino-1,2,4-triazol-4-yl)-2-(4-bromo-2-methyl-phenoxy)ethanone Formula: C11H11BrN4O2 MolecularWeight: 311.13464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC(=O)N2C=NN=C2N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC(=O)N2C=NN=C2N

InChI

InChI=1S/C11H11BrN4O2/c1-7-4-8(12)2-3-9(7)18-5-10(17)16-6-14-15-11(16)13/h2-4,6H,5H2,1H3,(H2,13,15)