7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 7,7-dimethyl-5-oxo-2-pyrrol-1-yl-4-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 7,7-dimethyl-5-oxo-2-(1-pyrrolyl)-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 7,7-dimethyl-5-oxo-2-pyrrol-1-yl-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 5-keto-7,7-dimethyl-2-pyrrol-1-yl-4-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C27H22F3N3OS MolecularWeight: 493.54329

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4)C#N)C5=CC=CS5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4)C#N)C5=CC=CS5)C(=O)C1)C

InChI

InChI=1S/C27H22F3N3OS/c1-26(2)14-20-24(21(34)15-26)23(22-9-6-12-35-22)19(16-31)25(32-10-3-4-11-32)33(20)18-8-5-7-17(13-18)27(28,29)30/h3-13,23H,14-15H2,1-2H3