methyl 2,5-dimethyl-4-(piperidin-1-ium-4-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 2,5-dimethyl-4-(piperidin-1-ium-4-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2,5-dimethyl-4-(piperidin-1-ium-4-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-4-(4-piperidin-1-iumylamino)-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2,5-dimethyl-4-(piperidin-1-ium-4-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,5-dimethyl-4-(piperidin-1-ium-4-ylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C15H21N4O2S+ MolecularWeight: 321.41784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NC3CC[NH2+]CC3)C)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NC3CC[NH2+]CC3)C)C(=O)OC

InChI

InChI=1S/C15H20N4O2S/c1-8-11-13(19-10-4-6-16-7-5-10)17-9(2)18-14(11)22-12(8)15(20)21-3/h10,16H,4-7H2,1-3H3,(H,17,18,19)/p+1