N-cyclooctyl-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclooctyl-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-cyclooctyl-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-cyclooctyl-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-cyclooctyl-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-cyclooctyl-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]acetamide Formula: C23H32N4O2S MolecularWeight: 428.59078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C23H32N4O2S/c28-22(24-18-8-4-2-1-3-5-9-18)17-30-23-19-10-6-7-11-20(19)25-21(26-23)16-27-12-14-29-15-13-27/h6-7,10-11,18H,1-5,8-9,12-17H2,(H,24,28)