2-azanyl-4-oxidanylidene-8-(phosphonooxymethyl)-1,5a,8,9a-tetrahydropyrano[3,2-g]pteridine-6,7-dithiolate

Systemtic Name: 2-azanyl-4-oxidanylidene-8-(phosphonooxymethyl)-1,5a,8,9a-tetrahydropyrano[3,2-g]pteridine-6,7-dithiolate Openeye Name: 2-amino-4-oxo-8-(phosphonooxymethyl)-1,5a,8,9a-tetrahydropyrano[3,2-g]pteridine-6,7-dithiolate CAS Name: 2-amino-4-oxo-8-(phosphonooxymethyl)-1,5a,8,9a-tetrahydropyrano[3,2-g]pteridine-6,7-dithiolate IUPAC Name: 2-amino-4-oxo-8-(phosphonooxymethyl)-1,5a,8,9a-tetrahydropyrano[3,2-g]pteridine-6,7-dithiolate Traditional Name: 2-amino-4-keto-8-(phosphonooxymethyl)-1,5a,8,9a-tetrahydropyrano[3,2-g]pteridine-6,7-dithiolate Formula: C10H10N5O6PS2-2 MolecularWeight: 391.320061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C1C(=C(C2C(O1)N=C3C(=N2)C(=O)N=C(N3)N)[S-])[S-])OP(=O)(O)O

Isomeric SMILES

C(C1C(=C(C2C(O1)N=C3C(=N2)C(=O)N=C(N3)N)[S-])[S-])OP(=O)(O)O

InChI

InChI=1S/C10H12N5O6PS2/c11-10-14-7-4(8(16)15-10)12-3-6(24)5(23)2(21-9(3)13-7)1-20-22(17,18)19/h2-3,9,23-24H,1H2,(H2,17,18,19)(H3,11,13,14,15,16)/p-2