2-(3-morpholin-4-yl-3-oxidanylidene-propyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-(3-morpholin-4-yl-3-oxidanylidene-propyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-(3-morpholino-3-oxo-propyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(4-morpholinyl)-3-oxopropyl]thio]-6-phenyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-(3-morpholin-4-yl-3-oxopropyl)sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(3-keto-3-morpholino-propyl)thio]-6-phenyl-4-(trifluoromethyl)nicotinonitrile Formula: C20H18F3N3O2S MolecularWeight: 421.43603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

C1COCCN1C(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C20H18F3N3O2S/c21-20(22,23)16-12-17(14-4-2-1-3-5-14)25-19(15(16)13-24)29-11-6-18(27)26-7-9-28-10-8-26/h1-5,12H,6-11H2