4-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[[3-(methylthio)-1H-1,2,4-triazol-5-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[3-(methylthio)-1H-1,2,4-triazol-5-yl]amino]butyric acid Formula: C7H10N4O3S MolecularWeight: 230.2443

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)NC(=O)CCC(=O)O

Isomeric SMILES

CSC1=NNC(=N1)NC(=O)CCC(=O)O

InChI

InChI=1S/C7H10N4O3S/c1-15-7-9-6(10-11-7)8-4(12)2-3-5(13)14/h2-3H2,1H3,(H,13,14)(H2,8,9,10,11,12)