6-methyl-2-(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-methyl-2-(2-morpholino-2-oxo-1-phenyl-ethyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-methyl-2-[[2-(4-morpholinyl)-2-oxo-1-phenylethyl]thio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-(2-morpholin-4-yl-2-oxo-1-phenylethyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(2-keto-2-morpholino-1-phenyl-ethyl)thio]-6-methyl-4-(trifluoromethyl)nicotinonitrile Formula: C20H18F3N3O2S MolecularWeight: 421.43603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C20H18F3N3O2S/c1-13-11-16(20(21,22)23)15(12-24)18(25-13)29-17(14-5-3-2-4-6-14)19(27)26-7-9-28-10-8-26/h2-6,11,17H,7-10H2,1H3