[(Z)-[(9aR)-2-azanyl-4-oxidanylidene-6-sulfanyl-7-sulfanylidene-1,5,9a,10-tetrahydropyrano[3,2-g]pteridin-8-ylidene]methyl] dihydrogen phosphate

Systemtic Name: [(Z)-[(9aR)-2-azanyl-4-oxidanylidene-6-sulfanyl-7-sulfanylidene-1,5,9a,10-tetrahydropyrano[3,2-g]pteridin-8-ylidene]methyl] dihydrogen phosphate Openeye Name: [(Z)-[(9aR)-2-amino-4-oxo-6-sulfanyl-7-thioxo-1,5,9a,10-tetrahydropyrano[3,2-g]pteridin-8-ylidene]methyl] dihydrogen phosphate CAS Name: [(Z)-[(9aR)-2-amino-6-mercapto-4-oxo-7-sulfanylidene-1,5,9a,10-tetrahydropyrano[3,2-g]pteridin-8-ylidene]methyl] dihydrogen phosphate IUPAC Name: [(Z)-[(9aR)-2-amino-4-oxo-6-sulfanyl-7-sulfanylidene-1,5,9a,10-tetrahydropyrano[3,2-g]pteridin-8-ylidene]methyl] dihydrogen phosphate Traditional Name: [(Z)-[(9aR)-2-amino-4-keto-6-mercapto-7-thioxo-1,5,9a,10-tetrahydropyrano[3,2-g]pteridin-8-ylidene]methyl] dihydrogen phosphate Formula: C10H10N5O6PS2 MolecularWeight: 391.320061

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Descriptors Computed from Structure

Canonical SMILES:

C(=C1C(=S)C(=C2C(O1)NC3=C(N2)C(=O)N=C(N3)N)S)OP(=O)(O)O

Isomeric SMILES

C(=C\1/C(=S)C(=C2[C@@H](O1)NC3=C(N2)C(=O)N=C(N3)N)S)\OP(=O)(O)O

InChI

InChI=1S/C10H10N5O6PS2/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/h1,9,12,24H,(H2,17,18,19)(H4,11,13,14,15,16)/b2-1-/t9-/m1/s1