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

Systemtic Name: 2-chloranyl-3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanyl-quinoline Openeye Name: 2-chloro-3-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-7-methylsulfanyl-quinoline CAS Name: 2-chloro-3-[[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-7-(methylthio)quinoline IUPAC Name: 2-chloro-3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanylquinoline Traditional Name: 2-chloro-3-[[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-7-(methylthio)quinoline Formula: C19H16ClN5S2 MolecularWeight: 413.94684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClN5S2/c1-25-18(12-5-7-21-8-6-12)23-24-19(25)27-11-14-9-13-3-4-15(26-2)10-16(13)22-17(14)20/h3-10H,11H2,1-2H3