3,5-dimethyl-4-oxidanylidene-2-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-6-carboxylic acid

Systemtic Name: 3,5-dimethyl-4-oxidanylidene-2-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-6-carboxylic acid Openeye Name: 3,5-dimethyl-4-oxo-2-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-6-carboxylic acid CAS Name: 3,5-dimethyl-4-oxo-2-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-6-carboxylic acid IUPAC Name: 3,5-dimethyl-4-oxo-2-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-6-carboxylic acid Traditional Name: 4-keto-3,5-dimethyl-2-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-6-carboxylic acid Formula: C15H13N2O3S+ MolecularWeight: 301.34032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=[N+](C(=O)C12)C)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC(=[N+](C(=O)C12)C)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C15H12N2O3S/c1-8-10-13(21-11(8)15(19)20)16-12(17(2)14(10)18)9-6-4-3-5-7-9/h3-7,10H,1-2H3/p+1