5-chloranyl-8-methyl-2-methylsulfanyl-[1,2,4]triazolo[5,1-b]purine

Systemtic Name: 5-chloranyl-8-methyl-2-methylsulfanyl-[1,2,4]triazolo[5,1-b]purine Openeye Name: 5-chloro-8-methyl-2-methylsulfanyl-[1,2,4]triazolo[5,1-b]purine CAS Name: 5-chloro-8-methyl-2-(methylthio)-[1,2,4]triazolo[5,1-b]purine IUPAC Name: 5-chloro-8-methyl-2-methylsulfanyl-[1,2,4]triazolo[5,1-b]purine Traditional Name: 5-chloro-8-methyl-2-(methylthio)-[1,2,4]triazolo[5,1-b]purine Formula: C8H7ClN6S MolecularWeight: 254.69938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N3C(=NC(=N3)SC)N=C2Cl

Isomeric SMILES

CN1C=NC2=C1N3C(=NC(=N3)SC)N=C2Cl

InChI

InChI=1S/C8H7ClN6S/c1-14-3-10-4-5(9)11-7-12-8(16-2)13-15(7)6(4)14/h3H,1-2H3