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

Systemtic Name: 2-azanyl-1-[2,6-bis(fluoranyl)phenyl]-7,7-dimethyl-5-oxidanylidene-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-4-(3-thiophenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(2,6-difluorophenyl)-5-keto-7,7-dimethyl-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H19F2N3OS MolecularWeight: 411.467566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=C(C=CC=C3F)F)N)C#N)C4=CSC=C4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=C(C=CC=C3F)F)N)C#N)C4=CSC=C4)C(=O)C1)C

InChI

InChI=1S/C22H19F2N3OS/c1-22(2)8-16-19(17(28)9-22)18(12-6-7-29-11-12)13(10-25)21(26)27(16)20-14(23)4-3-5-15(20)24/h3-7,11,18H,8-9,26H2,1-2H3