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

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

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

Isomeric SMILES

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

InChI

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