3-(2-chloranylprop-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(2-chloranylprop-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-(2-chloroallylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-(2-chloroprop-2-enylthio)-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(2-chloroprop-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(2-chloroallylthio)-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C13H14ClN3OS MolecularWeight: 295.78776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClN3OS/c1-10(14)9-19-13-16-15-12(18)17(13)8-7-11-5-3-2-4-6-11/h2-6H,1,7-9H2,(H,15,18)