3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[4-(methylthio)phenyl]methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[4-(methylthio)benzyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NNC(=O)N2CCC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NNC(=O)N2CCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS2/c1-23-16-9-7-15(8-10-16)13-24-18-20-19-17(22)21(18)12-11-14-5-3-2-4-6-14/h2-10H,11-13H2,1H3,(H,19,22)