4-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-(cyanomethylamino)-2-oxo-ethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-[[2-(cyanomethylamino)-2-oxoethyl]thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-[2-(cyanomethylamino)-2-oxoethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-[[2-(cyanomethylamino)-2-keto-ethyl]thio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C10H10N4O4S MolecularWeight: 282.2758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)NCC#N)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)NCC#N)C(=O)O

InChI

InChI=1S/C10H10N4O4S/c1-5-7(9(16)17)8(14-10(18)13-5)19-4-6(15)12-3-2-11/h3-4H2,1H3,(H,12,15)(H,16,17)(H,13,14,18)