6-ethyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-6-ethyl-2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-2-[(3-fluoro-4-methoxyphenyl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-6-ethyl-2-[(3-fluoro-4-methoxy-benzyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C19H19FN2O2S2 MolecularWeight: 390.494763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C19H19FN2O2S2/c1-4-8-22-18(23)14-10-13(5-2)26-17(14)21-19(22)25-11-12-6-7-16(24-3)15(20)9-12/h4,6-7,9-10H,1,5,8,11H2,2-3H3