6-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-3-methylsulfanyl-1,2,4-triazine-5-carboxylic acid

Systemtic Name: 6-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-3-methylsulfanyl-1,2,4-triazine-5-carboxylic acid Openeye Name: 6-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]-3-methylsulfanyl-1,2,4-triazine-5-carboxylic acid CAS Name: 6-[(2S)-2-amino-3-hydroxy-3-oxopropyl]-3-(methylthio)-1,2,4-triazine-5-carboxylic acid IUPAC Name: 6-[(2S)-2-amino-3-hydroxy-3-oxopropyl]-3-methylsulfanyl-1,2,4-triazine-5-carboxylic acid Traditional Name: 6-[(2S)-2-amino-3-hydroxy-3-keto-propyl]-3-(methylthio)-1,2,4-triazine-5-carboxylic acid Formula: C8H10N4O4S MolecularWeight: 258.2544

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(N=N1)CC(C(=O)O)N)C(=O)O

Isomeric SMILES

CSC1=NC(=C(N=N1)C[C@@H](C(=O)O)N)C(=O)O

InChI

InChI=1S/C8H10N4O4S/c1-17-8-10-5(7(15)16)4(11-12-8)2-3(9)6(13)14/h3H,2,9H2,1H3,(H,13,14)(H,15,16)/t3-/m0/s1