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

Systemtic Name: 2-[5-(4-tert-butylphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[5-(4-tert-butylphenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[5-(4-tert-butylphenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-[5-(4-tert-butylphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-[5-(4-tert-butylphenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-3-yl]acetic acid Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C19H20N2O3S/c1-11-15(12-5-7-13(8-6-12)19(2,3)4)16-17(25-11)20-10-21(18(16)24)9-14(22)23/h5-8,10H,9H2,1-4H3,(H,22,23)