4-methyl-3-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-methyl-3-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-methyl-3-(5-nitrothiazol-2-yl)sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-methyl-3-[(5-nitro-2-thiazolyl)thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-methyl-3-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-methyl-3-[(5-nitrothiazol-2-yl)thio]-1H-1,2,4-triazol-5-one Formula: C6H5N5O3S2 MolecularWeight: 259.2656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)NN=C1SC2=NC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)NN=C1SC2=NC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C6H5N5O3S2/c1-10-4(12)8-9-5(10)16-6-7-2-3(15-6)11(13)14/h2H,1H3,(H,8,12)