2-chloranyl-5-cyano-N-[3-[6-thiomorpholin-4-yl-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]benzamide

Systemtic Name: 2-chloranyl-5-cyano-N-[3-[6-thiomorpholin-4-yl-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]benzamide Openeye Name: 2-chloro-5-cyano-N-[3-[[6-thiomorpholino-4-(trifluoromethyl)-2-pyridyl]oxy]propyl]benzamide CAS Name: 2-chloro-5-cyano-N-[3-[[6-thiomorpholin-4-yl-4-(trifluoromethyl)-2-pyridinyl]oxy]propyl]benzamide IUPAC Name: 2-chloro-5-cyano-N-[3-[6-thiomorpholin-4-yl-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]benzamide Traditional Name: 2-chloro-5-cyano-N-[3-[[6-thiomorpholino-4-(trifluoromethyl)-2-pyridyl]oxy]propyl]benzamide Formula: C21H20ClF3N4O2S MolecularWeight: 484.92231

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=NC(=CC(=C2)C(F)(F)F)OCCCNC(=O)C3=C(C=CC(=C3)C#N)Cl

Isomeric SMILES

C1CSCCN1C2=NC(=CC(=C2)C(F)(F)F)OCCCNC(=O)C3=C(C=CC(=C3)C#N)Cl

InChI

InChI=1S/C21H20ClF3N4O2S/c22-17-3-2-14(13-26)10-16(17)20(30)27-4-1-7-31-19-12-15(21(23,24)25)11-18(28-19)29-5-8-32-9-6-29/h2-3,10-12H,1,4-9H2,(H,27,30)