N-cyclooctyl-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-cyclooctyl-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-cyclooctyl-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-cyclooctyl-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-cyclooctyl-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-cyclooctyl-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C22H25N3OS2 MolecularWeight: 411.5834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3OS2/c26-19(25-17-11-7-2-1-3-8-12-17)14-28-22-20-18(16-9-5-4-6-10-16)13-27-21(20)23-15-24-22/h4-6,9-10,13,15,17H,1-3,7-8,11-12,14H2,(H,25,26)