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

Systemtic Name: 3-(6-ethyl-2-methyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-[6-ethyl-2-methyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-(6-ethyl-2-methyl-4-oxo-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: 3-(6-ethyl-2-methyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-[6-ethyl-4-keto-2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C16H16N2O3S2 MolecularWeight: 348.43984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(N(C2=O)CCC(=O)O)C)C3=CC=CS3

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)CCC(=O)O)C)C3=CC=CS3

InChI

InChI=1S/C16H16N2O3S2/c1-3-10-13(11-5-4-8-22-11)14-15(23-10)17-9(2)18(16(14)21)7-6-12(19)20/h4-5,8H,3,6-7H2,1-2H3,(H,19,20)