2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-5-oxidanyl-pyran-4-one

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-5-oxidanyl-pyran-4-one Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-5-hydroxy-pyran-4-one CAS Name: 2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-5-hydroxy-4-pyranone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-5-hydroxypyran-4-one Traditional Name: 2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-5-hydroxy-pyran-4-one Formula: C8H8N4O3S MolecularWeight: 240.23912

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC=C(C1=O)O)CSC2=NNC(=N2)N

Isomeric SMILES

C1=C(OC=C(C1=O)O)CSC2=NNC(=N2)N

InChI

InChI=1S/C8H8N4O3S/c9-7-10-8(12-11-7)16-3-4-1-5(13)6(14)2-15-4/h1-2,14H,3H2,(H3,9,10,11,12)