N-(4-morpholin-4-ylphenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-morpholinophenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-morpholinophenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C18H18F3N3O2S MolecularWeight: 397.41463

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O2S/c19-18(20,21)13-1-6-17(22-11-13)27-12-16(25)23-14-2-4-15(5-3-14)24-7-9-26-10-8-24/h1-6,11H,7-10,12H2,(H,23,25)