3-[5-(4-fluorophenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-propanamide

Systemtic Name: 3-[5-(4-fluorophenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-propanamide Openeye Name: 3-[3-allyl-5-(4-fluorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-propanamide CAS Name: 3-[[5-(4-fluorophenyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]thio]-N-phenethylpropanamide IUPAC Name: 3-[5-(4-fluorophenyl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethylpropanamide Traditional Name: 3-[[3-allyl-5-(4-fluorophenyl)-4-keto-thieno[2,3-d]pyrimidin-2-yl]thio]-N-phenethyl-propionamide Formula: C26H24FN3O2S2 MolecularWeight: 493.616063

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCCC(=O)NCCC3=CC=CC=C3)SC=C2C4=CC=C(C=C4)F

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCCC(=O)NCCC3=CC=CC=C3)SC=C2C4=CC=C(C=C4)F

InChI

InChI=1S/C26H24FN3O2S2/c1-2-15-30-25(32)23-21(19-8-10-20(27)11-9-19)17-34-24(23)29-26(30)33-16-13-22(31)28-14-12-18-6-4-3-5-7-18/h2-11,17H,1,12-16H2,(H,28,31)