2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-6-methyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-6-methyl-4-(trifluoromethyl)nicotinonitrile Formula: C20H15F3N2O2S MolecularWeight: 404.40551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=C(C(=CC(=N3)C)C(F)(F)F)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=C(C(=CC(=N3)C)C(F)(F)F)C#N)C

InChI

InChI=1S/C20H15F3N2O2S/c1-10-4-14-13(7-18(26)27-17(14)5-11(10)2)9-28-19-15(8-24)16(20(21,22)23)6-12(3)25-19/h4-7H,9H2,1-3H3