3-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(2-chloro-7-methylsulfanyl-3-quinolyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[[2-chloro-7-(methylthio)-3-quinolinyl]methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(2-chloro-7-methylsulfanylquinolin-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[[2-chloro-7-(methylthio)-3-quinolyl]methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C13H12ClN5S2 MolecularWeight: 337.85088

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)CSC3=NNC(=N3)N)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)CSC3=NNC(=N3)N)Cl

InChI

InChI=1S/C13H12ClN5S2/c1-20-9-3-2-7-4-8(11(14)16-10(7)5-9)6-21-13-17-12(15)18-19-13/h2-5H,6H2,1H3,(H3,15,17,18,19)