3-[[(5R)-1-butyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-diethyl-azanium

Systemtic Name: 3-[[(5R)-1-butyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-diethyl-azanium Openeye Name: 3-[[(5R)-1-butyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl]methyleneamino]propyl-diethyl-ammonium CAS Name: 3-[[(5R)-1-butyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-diethylammonium IUPAC Name: 3-[[(5R)-1-butyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-diethylazanium Traditional Name: 3-[[(5R)-1-butyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl]methyleneamino]propyl-diethyl-ammonium Formula: C16H29N4O2S+ MolecularWeight: 341.49206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C(=O)NC1=S)C=NCCC[NH+](CC)CC

Isomeric SMILES

CCCCN1C(=O)[C@@H](C(=O)NC1=S)C=NCCC[NH+](CC)CC

InChI

InChI=1S/C16H28N4O2S/c1-4-7-11-20-15(22)13(14(21)18-16(20)23)12-17-9-8-10-19(5-2)6-3/h12-13H,4-11H2,1-3H3,(H,18,21,23)/p+1/t13-/m1/s1