4-[4-methyl-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazol-3-yl]-2-(4-methylphenyl)quinoline

Systemtic Name: 4-[4-methyl-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazol-3-yl]-2-(4-methylphenyl)quinoline Openeye Name: 4-[4-methyl-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazol-3-yl]-2-(p-tolyl)quinoline CAS Name: 4-[4-methyl-5-[2-(methylthio)ethylthio]-1,2,4-triazol-3-yl]-2-(4-methylphenyl)quinoline IUPAC Name: 4-[4-methyl-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazol-3-yl]-2-(4-methylphenyl)quinoline Traditional Name: 4-[4-methyl-5-[2-(methylthio)ethylthio]-1,2,4-triazol-3-yl]-2-(p-tolyl)quinoline Formula: C22H22N4S2 MolecularWeight: 406.56688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4C)SCCSC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4C)SCCSC

InChI

InChI=1S/C22H22N4S2/c1-15-8-10-16(11-9-15)20-14-18(17-6-4-5-7-19(17)23-20)21-24-25-22(26(21)2)28-13-12-27-3/h4-11,14H,12-13H2,1-3H3