N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C18H17F3N4O4S MolecularWeight: 442.41219

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N4O4S/c19-18(20,21)12-1-3-15(24-5-7-29-8-6-24)14(9-12)23-16(26)11-30-17-4-2-13(10-22-17)25(27)28/h1-4,9-10H,5-8,11H2,(H,23,26)