4-azanyl-3-(sulfanylmethyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-azanyl-3-(sulfanylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-amino-3-(sulfanylmethyl)-1H-1,2,4-triazol-5-one CAS Name: 4-amino-3-(mercaptomethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-amino-3-(sulfanylmethyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-amino-3-(mercaptomethyl)-1H-1,2,4-triazol-5-one Formula: C3H6N4OS MolecularWeight: 146.17094

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=NNC(=O)N1N)S

Isomeric SMILES

C(C1=NNC(=O)N1N)S

InChI

InChI=1S/C3H6N4OS/c4-7-2(1-9)5-6-3(7)8/h9H,1,4H2,(H,6,8)