1-(6-methoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(6-methoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(6-methoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-(6-methoxycarbonyl-5-methyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(6-methoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(6-carbomethoxy-5-methyl-thieno[2,3-d]pyrimidin-4-yl)isonipecotic acid Formula: C15H17N3O4S MolecularWeight: 335.37818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)O)C(=O)OC

InChI

InChI=1S/C15H17N3O4S/c1-8-10-12(18-5-3-9(4-6-18)14(19)20)16-7-17-13(10)23-11(8)15(21)22-2/h7,9H,3-6H2,1-2H3,(H,19,20)