4-(azepan-1-yl)-5-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(azepan-1-yl)-5-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(azepan-1-yl)-5-methyl-N-[2-(2-thienyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1-azepanyl)-5-methyl-N-(2-thiophen-2-ylethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(azepan-1-yl)-5-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(azepan-1-yl)-5-methyl-N-[2-(2-thienyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H24N4OS2 MolecularWeight: 400.56076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCCCCC3)C(=O)NCCC4=CC=CS4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCCCCC3)C(=O)NCCC4=CC=CS4

InChI

InChI=1S/C20H24N4OS2/c1-14-16-18(24-10-4-2-3-5-11-24)22-13-23-20(16)27-17(14)19(25)21-9-8-15-7-6-12-26-15/h6-7,12-13H,2-5,8-11H2,1H3,(H,21,25)