2-chloranyl-3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanyl-quinoline

Systemtic Name: 2-chloranyl-3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanyl-quinoline Openeye Name: 2-chloro-3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanyl-quinoline CAS Name: 2-chloro-3-[[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-7-(methylthio)quinoline IUPAC Name: 2-chloro-3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanylquinoline Traditional Name: 2-chloro-3-[[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-7-(methylthio)quinoline Formula: C20H17ClN4S2 MolecularWeight: 412.95878

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(N=C3C=C(C=CC3=C2)SC)Cl)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2=C(N=C3C=C(C=CC3=C2)SC)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN4S2/c1-25-19(13-6-4-3-5-7-13)23-24-20(25)27-12-15-10-14-8-9-16(26-2)11-17(14)22-18(15)21/h3-11H,12H2,1-2H3