4-[4-ethyl-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCSC)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCCSC)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

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