2-(4-methyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)ethyl carbamimidothioate bromide

Systemtic Name: 2-(4-methyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)ethyl carbamimidothioate bromide Openeye Name: 2-[2-(4-methyl-6-oxo-2-thioxo-hexahydropyrimidin-5-yl)ethyl]isothiourea bromide CAS Name: carbamimidothioic acid 2-(4-methyl-6-oxo-2-sulfanylidene-1,3-diazinan-5-yl)ethyl ester bromide IUPAC Name: 2-(4-methyl-6-oxo-2-sulfanylidene-1,3-diazinan-5-yl)ethyl carbamimidothioate bromide Traditional Name: 2-[2-(4-keto-6-methyl-2-thioxo-hexahydropyrimidin-5-yl)ethyl]isothiourea bromide Formula: C8H14BrN4OS2- MolecularWeight: 326.25696

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)NC(=S)N1)CCSC(=N)N.[Br-]

Isomeric SMILES

CC1C(C(=O)NC(=S)N1)CCSC(=N)N.[Br-]

InChI

InChI=1S/C8H14N4OS2.BrH/c1-4-5(2-3-15-7(9)10)6(13)12-8(14)11-4;/h4-5H,2-3H2,1H3,(H3,9,10)(H2,11,12,13,14);1H/p-1