N-(3-bromanyl-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-bromanyl-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-bromo-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-bromo-4-methoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-bromo-4-methoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-bromo-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C12H13BrN4O2S MolecularWeight: 357.22622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C12H13BrN4O2S/c1-17-7-14-16-12(17)20-6-11(18)15-8-3-4-10(19-2)9(13)5-8/h3-5,7H,6H2,1-2H3,(H,15,18)