4-(2,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-(2,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(2,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(2,4-dimethylphenyl)-3-[[4-(methylthio)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 4-(2,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-(2,4-dimethylphenyl)-3-[[4-(methylthio)benzyl]thio]-1,2,4-triazole Formula: C18H19N3S2 MolecularWeight: 341.49356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=NN=C2SCC3=CC=C(C=C3)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=NN=C2SCC3=CC=C(C=C3)SC)C

InChI

InChI=1S/C18H19N3S2/c1-13-4-9-17(14(2)10-13)21-12-19-20-18(21)23-11-15-5-7-16(22-3)8-6-15/h4-10,12H,11H2,1-3H3