(2S,4R)-2-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2S,4R)-2-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4R)-2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4R)-2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4R)-2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4R)-2-(2,4-diketo-6-methyl-1H-pyrimidin-5-yl)thiazolidin-3-ium-4-carboxylate Formula: C9H11N3O4S MolecularWeight: 257.26634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)C2[NH2+]C(CS2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)[C@H]2[NH2+][C@@H](CS2)C(=O)[O-]

InChI

InChI=1S/C9H11N3O4S/c1-3-5(6(13)12-9(16)10-3)7-11-4(2-17-7)8(14)15/h4,7,11H,2H2,1H3,(H,14,15)(H2,10,12,13,16)/t4-,7-/m0/s1