3-[(7-chloranylquinolin-4-yl)sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(7-chloranylquinolin-4-yl)sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(7-chloro-4-quinolyl)sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(7-chloro-4-quinolinyl)thio]methyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(7-chloroquinolin-4-yl)sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(7-chloro-4-quinolyl)thio]methyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C13H11ClN4S2 MolecularWeight: 322.83624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CSC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

CN1C(=NNC1=S)CSC2=C3C=CC(=CC3=NC=C2)Cl

InChI

InChI=1S/C13H11ClN4S2/c1-18-12(16-17-13(18)19)7-20-11-4-5-15-10-6-8(14)2-3-9(10)11/h2-6H,7H2,1H3,(H,17,19)