3-[[(5S)-1-ethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(5S)-1-ethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-dimethyl-azanium Openeye Name: 3-[[(5S)-1-ethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl]methyleneamino]propyl-dimethyl-ammonium CAS Name: 3-[[(5S)-1-ethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-dimethylammonium IUPAC Name: 3-[[(5S)-1-ethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]propyl-dimethylazanium Traditional Name: 3-[[(5S)-1-ethyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl]methyleneamino]propyl-dimethyl-ammonium Formula: C12H21N4O2S+ MolecularWeight: 285.38574

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(C(=O)NC1=S)C=NCCC[NH+](C)C

Isomeric SMILES

CCN1C(=O)[C@H](C(=O)NC1=S)C=NCCC[NH+](C)C

InChI

InChI=1S/C12H20N4O2S/c1-4-16-11(18)9(10(17)14-12(16)19)8-13-6-5-7-15(2)3/h8-9H,4-7H2,1-3H3,(H,14,17,19)/p+1/t9-/m0/s1