[5-ethyl-3-methyl-2,4,6-tris(oxidanylidene)-5-phenyl-1,3-diazinan-1-yl]methyl carbamimidothioate hydrobromide

Systemtic Name: [5-ethyl-3-methyl-2,4,6-tris(oxidanylidene)-5-phenyl-1,3-diazinan-1-yl]methyl carbamimidothioate hydrobromide Openeye Name: 2-[(5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-hexahydropyrimidin-1-yl)methyl]isothiourea hydrobromide CAS Name: carbamimidothioic acid (5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)methyl ester hydrobromide IUPAC Name: (5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)methyl carbamimidothioate hydrobromide Traditional Name: 2-[(5-ethyl-2,4,6-triketo-3-methyl-5-phenyl-hexahydropyrimidin-1-yl)methyl]isothiourea hydrobromide Formula: C15H19BrN4O3S MolecularWeight: 415.30536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C(=O)N(C1=O)CSC(=N)N)C)C2=CC=CC=C2.Br

Isomeric SMILES

CCC1(C(=O)N(C(=O)N(C1=O)CSC(=N)N)C)C2=CC=CC=C2.Br

InChI

InChI=1S/C15H18N4O3S.BrH/c1-3-15(10-7-5-4-6-8-10)11(20)18(2)14(22)19(12(15)21)9-23-13(16)17;/h4-8H,3,9H2,1-2H3,(H3,16,17);1H