2-azanyl-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-7,7-dimethyl-5-oxidanylidene-1-[4-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-7,7-dimethyl-5-oxidanylidene-1-[4-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(2-ethylsulfanyl-5-methyl-3-furyl)-7,7-dimethyl-5-oxo-1-[4-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-[2-(ethylthio)-5-methyl-3-furanyl]-7,7-dimethyl-5-oxo-1-[4-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2-ethylsulfanyl-5-methylfuran-3-yl)-7,7-dimethyl-5-oxo-1-[4-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-[2-(ethylthio)-5-methyl-3-furyl]-5-keto-7,7-dimethyl-1-[4-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H26F3N3O2S MolecularWeight: 501.56375

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=C(C=C4)C(F)(F)F)N)C#N

Isomeric SMILES

CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=C(C=C4)C(F)(F)F)N)C#N

InChI

InChI=1S/C26H26F3N3O2S/c1-5-35-24-17(10-14(2)34-24)21-18(13-30)23(31)32(16-8-6-15(7-9-16)26(27,28)29)19-11-25(3,4)12-20(33)22(19)21/h6-10,21H,5,11-12,31H2,1-4H3