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

Systemtic Name: (3S)-1-(6-methoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxylate Openeye Name: (3S)-1-(6-methoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxylate CAS Name: (3S)-1-(6-methoxycarbonyl-5-methyl-4-thieno[2,3-d]pyrimidinyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(6-methoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(6-carbomethoxy-5-methyl-thieno[2,3-d]pyrimidin-4-yl)nipecotate Formula: C15H16N3O4S- MolecularWeight: 334.37024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCCC(C3)C(=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC[C@@H](C3)C(=O)[O-])C(=O)OC

InChI

InChI=1S/C15H17N3O4S/c1-8-10-12(18-5-3-4-9(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)/p-1/t9-/m0/s1