3-[5-(4-fluorophenyl)-2,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: 3-[5-(4-fluorophenyl)-2,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[5-(4-fluorophenyl)-2,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[5-(4-fluorophenyl)-2,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[5-(4-fluorophenyl)-2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[5-(4-fluorophenyl)-4-keto-2,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C17H14FN2O3S- MolecularWeight: 345.368063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(N(C2=O)CCC(=O)[O-])C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C2=C(S1)N=C(N(C2=O)CCC(=O)[O-])C)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN2O3S/c1-9-14(11-3-5-12(18)6-4-11)15-16(24-9)19-10(2)20(17(15)23)8-7-13(21)22/h3-6H,7-8H2,1-2H3,(H,21,22)/p-1