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

Systemtic Name: 2-[2-methyl-4-oxidanylidene-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[5-(4-isopropylphenyl)-2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[2-methyl-4-oxo-5-(4-propan-2-ylphenyl)-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-[2-methyl-4-oxo-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-(4-keto-2-methyl-5-p-cumenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)N1CC(=O)O

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)N1CC(=O)O

InChI

InChI=1S/C18H18N2O3S/c1-10(2)12-4-6-13(7-5-12)14-9-24-17-16(14)18(23)20(8-15(21)22)11(3)19-17/h4-7,9-10H,8H2,1-3H3,(H,21,22)