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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN=CC1C(=O)NC(=S)NC1=O

Isomeric SMILES

CC[NH+](CC)CCCN=CC1C(=O)NC(=S)NC1=O

InChI

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