5-methyl-4-sulfanyl-1,2-dihydropyrazol-3-one

Systemtic Name: 5-methyl-4-sulfanyl-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-sulfanyl-1,2-dihydropyrazol-3-one CAS Name: 4-mercapto-5-methyl-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-sulfanyl-1,2-dihydropyrazol-3-one Traditional Name: 4-mercapto-5-methyl-3-pyrazolin-3-one Formula: C4H6N2OS MolecularWeight: 130.16824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)S

Isomeric SMILES

CC1=C(C(=O)NN1)S

InChI

InChI=1S/C4H6N2OS/c1-2-3(8)4(7)6-5-2/h8H,1H3,(H2,5,6,7)