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

Systemtic Name: 2-[5-butyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]ethyl carbamimidothioate Openeye Name: 2-[2-(5-butyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)ethyl]isothiourea CAS Name: carbamimidothioic acid 2-(5-butyl-2,4,6-trioxo-1,3-diazinan-5-yl)ethyl ester IUPAC Name: 2-(5-butyl-2,4,6-trioxo-1,3-diazinan-5-yl)ethyl carbamimidothioate Traditional Name: 2-[2-(5-butyl-2,4,6-triketo-hexahydropyrimidin-5-yl)ethyl]isothiourea Formula: C11H18N4O3S MolecularWeight: 286.35062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)NC(=O)NC1=O)CCSC(=N)N

Isomeric SMILES

CCCCC1(C(=O)NC(=O)NC1=O)CCSC(=N)N

InChI

InChI=1S/C11H18N4O3S/c1-2-3-4-11(5-6-19-9(12)13)7(16)14-10(18)15-8(11)17/h2-6H2,1H3,(H3,12,13)(H2,14,15,16,17,18)