8-[(7-methyl-2,1,3-benzoselenadiazol-4-yl)methylsulfanyl]-7H-purin-6-amine

Systemtic Name: 8-[(7-methyl-2,1,3-benzoselenadiazol-4-yl)methylsulfanyl]-7H-purin-6-amine Openeye Name: 8-[(7-methyl-2,1,3-benzoselenadiazol-4-yl)methylsulfanyl]-7H-purin-6-amine CAS Name: 8-[(7-methyl-2,1,3-benzoselenadiazol-4-yl)methylthio]-7H-purin-6-amine IUPAC Name: 8-[(7-methyl-2,1,3-benzoselenadiazol-4-yl)methylsulfanyl]-7H-purin-6-amine Traditional Name: [8-[(7-methylpiaselenol-4-yl)methylthio]-7H-purin-6-yl]amine Formula: C13H11N7SSe MolecularWeight: 376.29834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=N[Se]N=C12)CSC3=NC4=C(N3)C(=NC=N4)N

Isomeric SMILES

CC1=CC=C(C2=N[Se]N=C12)CSC3=NC4=C(N3)C(=NC=N4)N

InChI

InChI=1S/C13H11N7SSe/c1-6-2-3-7(9-8(6)19-22-20-9)4-21-13-17-10-11(14)15-5-16-12(10)18-13/h2-3,5H,4H2,1H3,(H3,14,15,16,17,18)