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

Systemtic Name: 2-[2,4,6-tris(oxidanylidene)-5-propyl-1,3-diazinan-5-yl]ethyl thiocyanate Openeye Name: 2-(2,4,6-trioxo-5-propyl-hexahydropyrimidin-5-yl)ethyl thiocyanate CAS Name: thiocyanic acid 2-(2,4,6-trioxo-5-propyl-1,3-diazinan-5-yl)ethyl ester IUPAC Name: 2-(2,4,6-trioxo-5-propyl-1,3-diazinan-5-yl)ethyl thiocyanate Traditional Name: thiocyanic acid 2-(2,4,6-triketo-5-propyl-hexahydropyrimidin-5-yl)ethyl ester Formula: C10H13N3O3S MolecularWeight: 255.29352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)NC(=O)NC1=O)CCSC#N

Isomeric SMILES

CCCC1(C(=O)NC(=O)NC1=O)CCSC#N

InChI

InChI=1S/C10H13N3O3S/c1-2-3-10(4-5-17-6-11)7(14)12-9(16)13-8(10)15/h2-5H2,1H3,(H2,12,13,14,15,16)