3-(4-oxidanylidene-5-phenyl-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: 3-(4-oxidanylidene-5-phenyl-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-[4-oxo-5-phenyl-2-(4-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-(4-oxo-5-phenyl-2-pyridin-4-yl-3-thieno[2,3-d]pyrimidinyl)propanoate IUPAC Name: 3-(4-oxo-5-phenyl-2-pyridin-4-ylthieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-[4-keto-5-phenyl-2-(4-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C20H14N3O3S- MolecularWeight: 376.40846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C4=CC=NC=C4)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C4=CC=NC=C4)CCC(=O)[O-]

InChI

InChI=1S/C20H15N3O3S/c24-16(25)8-11-23-18(14-6-9-21-10-7-14)22-19-17(20(23)26)15(12-27-19)13-4-2-1-3-5-13/h1-7,9-10,12H,8,11H2,(H,24,25)/p-1