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

Systemtic Name: 3-[6-aminocarbonyl-2-(2-methoxyethyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid Openeye Name: 3-[6-carbamoyl-2-(2-methoxyethyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-[6-carbamoyl-2-(2-methoxyethyl)-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 3-[6-carbamoyl-2-(2-methoxyethyl)-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid Traditional Name: 3-[6-carbamoyl-4-keto-2-(2-methoxyethyl)-5-methyl-thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)CCOC)CCC(=O)O)C(=O)N

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)CCOC)CCC(=O)O)C(=O)N

InChI

InChI=1S/C14H17N3O5S/c1-7-10-13(23-11(7)12(15)20)16-8(4-6-22-2)17(14(10)21)5-3-9(18)19/h3-6H2,1-2H3,(H2,15,20)(H,18,19)