2-ethyl-4,5-dimethyl-N-[1-(phenylmethyl)pyridin-1-ium-2-yl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-ethyl-4,5-dimethyl-N-[1-(phenylmethyl)pyridin-1-ium-2-yl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(1-benzylpyridin-1-ium-2-yl)-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-ethyl-4,5-dimethyl-N-[1-(phenylmethyl)-2-pyridin-1-iumyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(1-benzylpyridin-1-ium-2-yl)-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(1-benzylpyridin-1-ium-2-yl)-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H23N4OS+ MolecularWeight: 403.51992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NC3=CC=CC=[N+]3CC4=CC=CC=C4)C)C

Isomeric SMILES

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NC3=CC=CC=[N+]3CC4=CC=CC=C4)C)C

InChI

InChI=1S/C23H22N4OS/c1-4-18-24-16(3)20-15(2)21(29-23(20)25-18)22(28)26-19-12-8-9-13-27(19)14-17-10-6-5-7-11-17/h5-13H,4,14H2,1-3H3/p+1