2-[2-azanyl-6-(dimethylamino)-4-oxidanylidene-1H-1,3,5-triazin-3-ium-3-yl]ethyl thiocyanate

Systemtic Name: 2-[2-azanyl-6-(dimethylamino)-4-oxidanylidene-1H-1,3,5-triazin-3-ium-3-yl]ethyl thiocyanate Openeye Name: 2-[2-amino-6-(dimethylamino)-4-oxo-1H-1,3,5-triazin-3-ium-3-yl]ethyl thiocyanate CAS Name: thiocyanic acid 2-[2-amino-6-(dimethylamino)-4-oxo-1H-1,3,5-triazin-3-ium-3-yl]ethyl ester IUPAC Name: 2-[2-amino-6-(dimethylamino)-4-oxo-1H-1,3,5-triazin-3-ium-3-yl]ethyl thiocyanate Traditional Name: thiocyanic acid 2-[2-amino-6-(dimethylamino)-4-keto-1H-s-triazin-3-ium-3-yl]ethyl ester Formula: C8H13N6OS+ MolecularWeight: 241.29342

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=O)[N+](=C(N1)N)CCSC#N

Isomeric SMILES

CN(C)C1=NC(=O)[N+](=C(N1)N)CCSC#N

InChI

InChI=1S/C8H12N6OS/c1-13(2)7-11-6(10)14(8(15)12-7)3-4-16-5-9/h3-4H2,1-2H3,(H2,10,11,12,15)/p+1