1-butan-2-yl-7-methyl-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid

Systemtic Name: 1-butan-2-yl-7-methyl-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid Openeye Name: 7-methyl-4-oxo-1-sec-butyl-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid CAS Name: 1-butan-2-yl-7-methyl-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 1-butan-2-yl-7-methyl-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylic acid Traditional Name: 4-keto-7-methyl-1-sec-butyl-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C(=CC(=N2)C)C(=O)O)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C2=C(C(=CC(=N2)C)C(=O)O)C(=O)NC1=S

InChI

InChI=1S/C13H15N3O3S/c1-4-7(3)16-10-9(11(17)15-13(16)20)8(12(18)19)5-6(2)14-10/h5,7H,4H2,1-3H3,(H,18,19)(H,15,17,20)