2-(2-azanylidene-5-ethyl-1,3,4-thiadiazol-3-yl)-1-(4-methoxyphenyl)ethanone hydrobromide

Systemtic Name: 2-(2-azanylidene-5-ethyl-1,3,4-thiadiazol-3-yl)-1-(4-methoxyphenyl)ethanone hydrobromide Openeye Name: 2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(4-methoxyphenyl)ethanone hydrobromide CAS Name: 2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(4-methoxyphenyl)ethanone hydrobromide IUPAC Name: 2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(4-methoxyphenyl)ethanone hydrobromide Traditional Name: 2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(4-methoxyphenyl)ethanone hydrobromide Formula: C13H16BrN3O2S MolecularWeight: 358.25404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=N)S1)CC(=O)C2=CC=C(C=C2)OC.Br

Isomeric SMILES

CCC1=NN(C(=N)S1)CC(=O)C2=CC=C(C=C2)OC.Br

InChI

InChI=1S/C13H15N3O2S.BrH/c1-3-12-15-16(13(14)19-12)8-11(17)9-4-6-10(18-2)7-5-9;/h4-7,14H,3,8H2,1-2H3;1H