2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole

Systemtic Name: 2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole Openeye Name: 2-[(2-chloro-7-methylsulfanyl-3-quinolyl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole CAS Name: 2-[[2-chloro-7-(methylthio)-3-quinolinyl]methylthio]-5-methyl-1,3,4-thiadiazole IUPAC Name: 2-[(2-chloro-7-methylsulfanylquinolin-3-yl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole Traditional Name: 2-[[2-chloro-7-(methylthio)-3-quinolyl]methylthio]-5-methyl-1,3,4-thiadiazole Formula: C14H12ClN3S3 MolecularWeight: 353.91318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

CC1=NN=C(S1)SCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C14H12ClN3S3/c1-8-17-18-14(21-8)20-7-10-5-9-3-4-11(19-2)6-12(9)16-13(10)15/h3-6H,7H2,1-2H3