(2R)-2-[4-oxidanylidene-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: (2R)-2-[4-oxidanylidene-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: (2R)-2-[5-(4-isopropylphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: (2R)-2-[4-oxo-5-(4-propan-2-ylphenyl)-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: (2R)-2-[4-oxo-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: (2R)-2-(4-keto-5-p-cumenyl-thieno[2,3-d]pyrimidin-3-yl)propionate Formula: C18H17N2O3S- MolecularWeight: 341.40418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)[O-])N1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C18H18N2O3S/c1-10(2)12-4-6-13(7-5-12)14-8-24-16-15(14)17(21)20(9-19-16)11(3)18(22)23/h4-11H,1-3H3,(H,22,23)/p-1/t11-/m1/s1