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

Systemtic Name: 5-oxidanylidene-2-pyrrol-1-yl-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 5-oxo-2-pyrrol-1-yl-4-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 5-oxo-2-(1-pyrrolyl)-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 5-oxo-2-pyrrol-1-yl-4-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 5-keto-2-pyrrol-1-yl-4-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H18F3N3OS MolecularWeight: 465.49013

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4)C#N)C5=CC=CS5)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4)C#N)C5=CC=CS5)C(=O)C1

InChI

InChI=1S/C25H18F3N3OS/c26-25(27,28)16-6-3-7-17(14-16)31-19-8-4-9-20(32)23(19)22(21-10-5-13-33-21)18(15-29)24(31)30-11-1-2-12-30/h1-3,5-7,10-14,22H,4,8-9H2