3-methylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-methylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-methylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-(methylthio)-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-methylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(methylthio)-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=O)N1CCC2=CC=CC=C2

Isomeric SMILES

CSC1=NNC(=O)N1CCC2=CC=CC=C2

InChI

InChI=1S/C11H13N3OS/c1-16-11-13-12-10(15)14(11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,12,15)