4-chloranyl-2-methyl-3-methylsulfanyl-1H-pyrazol-5-one

Systemtic Name: 4-chloranyl-2-methyl-3-methylsulfanyl-1H-pyrazol-5-one Openeye Name: 4-chloro-2-methyl-3-methylsulfanyl-1H-pyrazol-5-one CAS Name: 4-chloro-2-methyl-3-(methylthio)-1H-pyrazol-5-one IUPAC Name: 4-chloro-2-methyl-3-methylsulfanyl-1H-pyrazol-5-one Traditional Name: 4-chloro-1-methyl-5-(methylthio)-3-pyrazolin-3-one Formula: C5H7ClN2OS MolecularWeight: 178.63988

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1)Cl)SC

Isomeric SMILES

CN1C(=C(C(=O)N1)Cl)SC

InChI

InChI=1S/C5H7ClN2OS/c1-8-5(10-2)3(6)4(9)7-8/h1-2H3,(H,7,9)