2-[2,4,6-tris(oxidanylidene)-5-propyl-1,3-diazinan-5-yl]ethyl carbamimidothioate bromide

Systemtic Name: 2-[2,4,6-tris(oxidanylidene)-5-propyl-1,3-diazinan-5-yl]ethyl carbamimidothioate bromide Openeye Name: 2-[2-(2,4,6-trioxo-5-propyl-hexahydropyrimidin-5-yl)ethyl]isothiourea bromide CAS Name: carbamimidothioic acid 2-(2,4,6-trioxo-5-propyl-1,3-diazinan-5-yl)ethyl ester bromide IUPAC Name: 2-(2,4,6-trioxo-5-propyl-1,3-diazinan-5-yl)ethyl carbamimidothioate bromide Traditional Name: 2-[2-(2,4,6-triketo-5-propyl-hexahydropyrimidin-5-yl)ethyl]isothiourea bromide Formula: C10H16BrN4O3S- MolecularWeight: 352.22804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)NC(=O)NC1=O)CCSC(=N)N.[Br-]

Isomeric SMILES

CCCC1(C(=O)NC(=O)NC1=O)CCSC(=N)N.[Br-]

InChI

InChI=1S/C10H16N4O3S.BrH/c1-2-3-10(4-5-18-8(11)12)6(15)13-9(17)14-7(10)16;/h2-5H2,1H3,(H3,11,12)(H2,13,14,15,16,17);1H/p-1