2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone hydrobromide

Systemtic Name: 2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone hydrobromide Openeye Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone hydrobromide CAS Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-(4-ethoxyphenyl)ethanone hydrobromide IUPAC Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone hydrobromide Traditional Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-p-phenetyl-ethanone hydrobromide Formula: C13H17BrN4O2S MolecularWeight: 373.26868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2N)C.Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2N)C.Br

InChI

InChI=1S/C13H16N4O2S.BrH/c1-3-19-11-6-4-10(5-7-11)12(18)8-20-13-16-15-9(2)17(13)14;/h4-7H,3,8,14H2,1-2H3;1H