(4-tert-butyl-2-methyl-phenyl) 3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 3-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)CCN2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)CCN2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C22H26N2O3S/c1-13-11-16(22(4,5)6)7-8-17(13)27-18(25)9-10-24-12-23-20-19(21(24)26)14(2)15(3)28-20/h7-8,11-12H,9-10H2,1-6H3