2-[5-(2-methoxy-5-methyl-phenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-(2-methoxy-5-methyl-phenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[5-(2-methoxy-5-methyl-phenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[5-(2-methoxy-5-methylphenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-[5-(2-methoxy-5-methylphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-[4-keto-5-(2-methoxy-5-methyl-phenyl)-6-methyl-thieno[2,3-d]pyrimidin-3-yl]acetic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)O)C

InChI

InChI=1S/C17H16N2O4S/c1-9-4-5-12(23-3)11(6-9)14-10(2)24-16-15(14)17(22)19(8-18-16)7-13(20)21/h4-6,8H,7H2,1-3H3,(H,20,21)