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

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-methyl-2-thiophenyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-methylthiophen-2-yl)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H16BrClF3N3OS MolecularWeight: 542.79915

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC(=C4)C(F)(F)F)Cl)N)C#N)Br

Isomeric SMILES

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC(=C4)C(F)(F)F)Cl)N)C#N)Br

InChI

InChI=1S/C22H16BrClF3N3OS/c1-10-13(23)8-18(32-10)19-12(9-28)21(29)30(15-3-2-4-17(31)20(15)19)16-7-11(22(25,26)27)5-6-14(16)24/h5-8,19H,2-4,29H2,1H3