3-(2-ethyl-6-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid

Systemtic Name: 3-(2-ethyl-6-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-(2-ethyl-6-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid CAS Name: 3-(2-ethyl-6-methyl-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: 3-(2-ethyl-6-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-(2-ethyl-4-keto-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)N1CCC(=O)O

Isomeric SMILES

CCC1=NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)N1CCC(=O)O

InChI

InChI=1S/C18H18N2O3S/c1-3-13-19-17-16(18(23)20(13)10-9-14(21)22)15(11(2)24-17)12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,21,22)