tert-butyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: tert-butyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: tert-butyl 2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid tert-butyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

InChI

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