6-tert-butyl-2-[(6-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-tert-butyl-2-[(6-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-tert-butyl-2-[(6-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-tert-butyl-2-[(6-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-tert-butyl-2-[(6-methyl-2-oxochromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-tert-butyl-2-[(2-keto-6-methyl-chromen-4-yl)methylthio]-4-(trifluoromethyl)nicotinonitrile Formula: C22H19F3N2O2S MolecularWeight: 432.45867

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C=C2CSC3=C(C(=CC(=N3)C(C)(C)C)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C=C2CSC3=C(C(=CC(=N3)C(C)(C)C)C(F)(F)F)C#N

InChI

InChI=1S/C22H19F3N2O2S/c1-12-5-6-17-14(7-12)13(8-19(28)29-17)11-30-20-15(10-26)16(22(23,24)25)9-18(27-20)21(2,3)4/h5-9H,11H2,1-4H3