2-[[1,3-bis(oxidanyl)-2H-purin-8-yl]sulfanyl]-5-nitro-1,3-thiazole

Systemtic Name: 2-[[1,3-bis(oxidanyl)-2H-purin-8-yl]sulfanyl]-5-nitro-1,3-thiazole Openeye Name: 2-[(1,3-dihydroxy-2H-purin-8-yl)sulfanyl]-5-nitro-thiazole CAS Name: 2-[(1,3-dihydroxy-2H-purin-8-yl)thio]-5-nitrothiazole IUPAC Name: 2-[(1,3-dihydroxy-2H-purin-8-yl)sulfanyl]-5-nitro-1,3-thiazole Traditional Name: 2-[(1,3-dihydroxy-2H-purin-8-yl)thio]-5-nitro-thiazole Formula: C8H6N6O4S2 MolecularWeight: 314.30104

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C=C2C(=NC(=N2)SC3=NC=C(S3)[N+](=O)[O-])N1O)O

Isomeric SMILES

C1N(C=C2C(=NC(=N2)SC3=NC=C(S3)[N+](=O)[O-])N1O)O

InChI

InChI=1S/C8H6N6O4S2/c15-12-2-4-6(13(16)3-12)11-7(10-4)20-8-9-1-5(19-8)14(17)18/h1-2,15-16H,3H2