2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: 2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-N-(4-morpholinophenyl)propanamide CAS Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-(4-morpholinophenyl)propionamide Formula: C20H20ClF3N2O2S MolecularWeight: 444.89821

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C20H20ClF3N2O2S/c1-13(29-16-6-7-18(21)17(12-16)20(22,23)24)19(27)25-14-2-4-15(5-3-14)26-8-10-28-11-9-26/h2-7,12-13H,8-11H2,1H3,(H,25,27)