[4-azanyl-6-(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]-(2-methoxy-2-oxidanylidene-ethyl)-dimethyl-azanium

Systemtic Name: [4-azanyl-6-(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]-(2-methoxy-2-oxidanylidene-ethyl)-dimethyl-azanium Openeye Name: [4-amino-6-(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]-(2-methoxy-2-oxo-ethyl)-dimethyl-ammonium CAS Name: [4-amino-6-(carboxymethylthio)-1,3,5-triazin-2-yl]-(2-methoxy-2-oxoethyl)-dimethylammonium IUPAC Name: [4-amino-6-(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]-(2-methoxy-2-oxoethyl)-dimethylazanium Traditional Name: [4-amino-6-(carboxymethylthio)-s-triazin-2-yl]-(2-keto-2-methoxy-ethyl)-dimethyl-ammonium Formula: C10H16N5O4S+ MolecularWeight: 302.33014

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(=O)OC)C1=NC(=NC(=N1)N)SCC(=O)O

Isomeric SMILES

C[N+](C)(CC(=O)OC)C1=NC(=NC(=N1)N)SCC(=O)O

InChI

InChI=1S/C10H15N5O4S/c1-15(2,4-7(18)19-3)9-12-8(11)13-10(14-9)20-5-6(16)17/h4-5H2,1-3H3,(H2-,11,12,13,14,16,17)/p+1