8-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-7H-purin-6-amine

Systemtic Name: 8-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-7H-purin-6-amine Openeye Name: 8-(5-nitrothiazol-2-yl)sulfanyl-7H-purin-6-amine CAS Name: 8-[(5-nitro-2-thiazolyl)thio]-7H-purin-6-amine IUPAC Name: 8-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-7H-purin-6-amine Traditional Name: [8-[(5-nitrothiazol-2-yl)thio]-7H-purin-6-yl]amine Formula: C8H5N7O2S2 MolecularWeight: 295.301

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=N1)SC2=NC3=C(N2)C(=NC=N3)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=N1)SC2=NC3=C(N2)C(=NC=N3)N)[N+](=O)[O-]

InChI

InChI=1S/C8H5N7O2S2/c9-5-4-6(12-2-11-5)14-7(13-4)19-8-10-1-3(18-8)15(16)17/h1-2H,(H3,9,11,12,13,14)