2-[(6-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[(6-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[(6-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[(6-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[(6-methyl-2-oxochromen-4-yl)methylsulfanyl]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[(2-keto-6-methyl-chromen-4-yl)methylthio]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H17F3N2O2S MolecularWeight: 430.44279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=C(CCCC4)C(=C3C#N)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=C(CCCC4)C(=C3C#N)C(F)(F)F

InChI

InChI=1S/C22H17F3N2O2S/c1-12-6-7-18-15(8-12)13(9-19(28)29-18)11-30-21-16(10-26)20(22(23,24)25)14-4-2-3-5-17(14)27-21/h6-9H,2-5,11H2,1H3