3-acetamido-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: 3-acetamido-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 3-acetamido-4-(4-fluorophenyl)sulfanyl-N-(3-morpholinopropyl)benzamide CAS Name: 3-acetamido-4-[(4-fluorophenyl)thio]-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 3-acetamido-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 3-acetamido-4-[(4-fluorophenyl)thio]-N-(3-morpholinopropyl)benzamide Formula: C22H26FN3O3S MolecularWeight: 431.523543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)NCCCN2CCOCC2)SC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)NCCCN2CCOCC2)SC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O3S/c1-16(27)25-20-15-17(3-8-21(20)30-19-6-4-18(23)5-7-19)22(28)24-9-2-10-26-11-13-29-14-12-26/h3-8,15H,2,9-14H2,1H3,(H,24,28)(H,25,27)