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

Systemtic Name: 2-[2-methyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[2-methyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[2-methyl-5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-[2-methyl-5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-[4-keto-2-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetic acid Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C)CC(=O)O

InChI

InChI=1S/C16H14N2O3S/c1-9-3-5-11(6-4-9)12-8-22-15-14(12)16(21)18(7-13(19)20)10(2)17-15/h3-6,8H,7H2,1-2H3,(H,19,20)