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

Systemtic Name: 2-(6-cyclohexyloxycarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 2-[6-(cyclohexoxycarbonyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 2-[6-[cyclohexyloxy(oxo)methyl]-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 2-(6-cyclohexyloxycarbonyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 2-[6-(cyclohexoxycarbonyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)O)C(=O)OC3CCCCC3

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)O)C(=O)OC3CCCCC3

InChI

InChI=1S/C17H20N2O5S/c1-9-12-14(18-8-19(15(12)20)10(2)16(21)22)25-13(9)17(23)24-11-6-4-3-5-7-11/h8,10-11H,3-7H2,1-2H3,(H,21,22)