4-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(2,4-dioxopyrimidin-1-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(2,4-dioxo-1-pyrimidinyl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(2,4-dioxopyrimidin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(2,4-diketopyrimidin-1-yl)methyl]thiazole-2-carboxylic acid Formula: C9H7N3O4S MolecularWeight: 253.23458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)NC1=O)CC2=CSC(=N2)C(=O)O

Isomeric SMILES

C1=CN(C(=O)NC1=O)CC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C9H7N3O4S/c13-6-1-2-12(9(16)11-6)3-5-4-17-7(10-5)8(14)15/h1-2,4H,3H2,(H,14,15)(H,11,13,16)