ethanedioic acid; 2-methyl-4-piperidin-1-yl-thieno[2,3-d]pyrimidine

Systemtic Name: ethanedioic acid; 2-methyl-4-piperidin-1-yl-thieno[2,3-d]pyrimidine Openeye Name: 2-methyl-4-(1-piperidyl)thieno[2,3-d]pyrimidine; oxalic acid CAS Name: 2-methyl-4-(1-piperidinyl)thieno[2,3-d]pyrimidine; oxalic acid IUPAC Name: 2-methyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine; oxalic acid Traditional Name: 2-methyl-4-piperidino-thieno[2,3-d]pyrimidine; oxalic acid Formula: C14H17N3O4S MolecularWeight: 323.36748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C=CSC2=N1)N3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NC(=C2C=CSC2=N1)N3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H15N3S.C2H2O4/c1-9-13-11(15-6-3-2-4-7-15)10-5-8-16-12(10)14-9;3-1(4)2(5)6/h5,8H,2-4,6-7H2,1H3;(H,3,4)(H,5,6)