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

Systemtic Name: 5-methyl-4-oxidanylidene-3-[(4-propan-2-ylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 3-[(4-isopropylphenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-oxo-3-[(4-propan-2-ylphenyl)methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-4-oxo-3-[(4-propan-2-ylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 3-(4-isopropylbenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=C(C=C3)C(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=C(C=C3)C(C)C)C(=O)O

InChI

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