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

Systemtic Name: (2R)-2-(6-ethyl-2-methyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: (2R)-2-[6-ethyl-2-methyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: (2R)-2-(6-ethyl-2-methyl-4-oxo-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: (2R)-2-(6-ethyl-2-methyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: (2R)-2-[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)C(C)C(=O)O)C)C3=CC=CS3

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)[C@H](C)C(=O)O)C)C3=CC=CS3

InChI

InChI=1S/C16H16N2O3S2/c1-4-10-12(11-6-5-7-22-11)13-14(23-10)17-9(3)18(15(13)19)8(2)16(20)21/h5-8H,4H2,1-3H3,(H,20,21)/t8-/m1/s1