5-methyl-3-[2-(3-methylphenoxy)ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-3-[2-(3-methylphenoxy)ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-3-[2-(3-methylphenoxy)ethyl]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-3-[2-(3-methylphenoxy)ethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-3-[2-(3-methylphenoxy)ethyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-keto-5-methyl-3-[2-(3-methylphenoxy)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN2C=NC3=C(C2=O)C(=C(S3)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCN2C=NC3=C(C2=O)C(=C(S3)C(=O)O)C

InChI

InChI=1S/C17H16N2O4S/c1-10-4-3-5-12(8-10)23-7-6-19-9-18-15-13(16(19)20)11(2)14(24-15)17(21)22/h3-5,8-9H,6-7H2,1-2H3,(H,21,22)