6-tert-butyl-2-[4-(2,3-dihydroindol-1-yl)-4-oxidanylidene-butyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-tert-butyl-2-[4-(2,3-dihydroindol-1-yl)-4-oxidanylidene-butyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-tert-butyl-2-(4-indolin-1-yl-4-oxo-butyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-tert-butyl-2-[[4-(2,3-dihydroindol-1-yl)-4-oxobutyl]thio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-tert-butyl-2-[4-(2,3-dihydroindol-1-yl)-4-oxobutyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-tert-butyl-2-[(4-indolin-1-yl-4-keto-butyl)thio]-4-(trifluoromethyl)nicotinonitrile Formula: C23H24F3N3OS MolecularWeight: 447.51637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)N2CCC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C23H24F3N3OS/c1-22(2,3)19-13-17(23(24,25)26)16(14-27)21(28-19)31-12-6-9-20(30)29-11-10-15-7-4-5-8-18(15)29/h4-5,7-8,13H,6,9-12H2,1-3H3