3-[5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-phenyl-propanamide

Systemtic Name: 3-[5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-phenyl-propanamide Openeye Name: 3-[5-(4-fluorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-phenyl-propanamide CAS Name: 3-[5-(4-fluorophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-phenylpropanamide IUPAC Name: 3-[5-(4-fluorophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-phenylpropanamide Traditional Name: 3-[5-(4-fluorophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]-N-phenyl-propionamide Formula: C21H16FN3O2S MolecularWeight: 393.434043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O2S/c22-15-8-6-14(7-9-15)17-12-28-20-19(17)21(27)25(13-23-20)11-10-18(26)24-16-4-2-1-3-5-16/h1-9,12-13H,10-11H2,(H,24,26)