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

Systemtic Name: 2-chloranyl-3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanyl-quinoline Openeye Name: 2-chloro-3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanyl-quinoline CAS Name: 2-chloro-3-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-7-(methylthio)quinoline IUPAC Name: 2-chloro-3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylsulfanylquinoline Traditional Name: 2-chloro-3-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-7-(methylthio)quinoline Formula: C15H15ClN4S2 MolecularWeight: 350.8894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

CC1=NN=C(N1C)SCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C15H15ClN4S2/c1-9-18-19-15(20(9)2)22-8-11-6-10-4-5-12(21-3)7-13(10)17-14(11)16/h4-7H,8H2,1-3H3