5-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylate IUPAC Name: 5-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-furoate Formula: C9H9N4O3S- MolecularWeight: 253.25776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

CC1=NN=C(N1N)SCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C9H10N4O3S/c1-5-11-12-9(13(5)10)17-4-6-2-3-7(16-6)8(14)15/h2-3H,4,10H2,1H3,(H,14,15)/p-1