2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-5-methyl-1,2-oxazol-3-one

Systemtic Name: 2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-5-methyl-1,2-oxazol-3-one Openeye Name: 2-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-5-methyl-isoxazol-3-one CAS Name: 2-[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-5-methyl-3-isoxazolone IUPAC Name: 2-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-5-methyl-1,2-oxazol-3-one Traditional Name: 2-[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetyl]-5-methyl-4-isoxazolin-3-one Formula: C8H9N5O3S MolecularWeight: 255.25376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(O1)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CC1=CC(=O)N(O1)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C8H9N5O3S/c1-4-2-5(14)13(16-4)6(15)3-17-8-10-7(9)11-12-8/h2H,3H2,1H3,(H3,9,10,11,12)