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

Systemtic Name: 3-(6-ethyl-4-oxidanylidene-2-propyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-[6-ethyl-4-oxo-2-propyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-(6-ethyl-4-oxo-2-propyl-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: 3-(6-ethyl-4-oxo-2-propyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-[6-ethyl-4-keto-2-propyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=C(S2)CC)C3=CC=CS3)C(=O)N1CCC(=O)O

Isomeric SMILES

CCCC1=NC2=C(C(=C(S2)CC)C3=CC=CS3)C(=O)N1CCC(=O)O

InChI

InChI=1S/C18H20N2O3S2/c1-3-6-13-19-17-16(18(23)20(13)9-8-14(21)22)15(11(4-2)25-17)12-7-5-10-24-12/h5,7,10H,3-4,6,8-9H2,1-2H3,(H,21,22)