N-[3-(azepan-1-ylsulfonyl)phenyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-cyclopropyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-cyclopropyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H28N4O3S2 MolecularWeight: 484.63412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C24H28N4O3S2/c1-15-20-16(2)25-22(17-10-11-17)27-24(20)32-21(15)23(29)26-18-8-7-9-19(14-18)33(30,31)28-12-5-3-4-6-13-28/h7-9,14,17H,3-6,10-13H2,1-2H3,(H,26,29)