3-methylsulfanyl-4-(phenylmethyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 3-methylsulfanyl-4-(phenylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-benzyl-3-methylsulfanyl-1H-1,2,4-triazol-5-one CAS Name: 3-(methylthio)-4-(phenylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-benzyl-3-methylsulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-benzyl-3-(methylthio)-1H-1,2,4-triazol-5-one Formula: C10H11N3OS MolecularWeight: 221.27884

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=O)N1CC2=CC=CC=C2

Isomeric SMILES

CSC1=NNC(=O)N1CC2=CC=CC=C2

InChI

InChI=1S/C10H11N3OS/c1-15-10-12-11-9(14)13(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,14)