2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(3-chloranyl-4-fluoranyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(3-chloranyl-4-fluoranyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(3-chloro-4-fluoro-phenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-ethyl-2-thiophenyl)-1-(3-chloro-4-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-1-(3-chloro-4-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(3-chloro-4-fluoro-phenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H18BrClFN3OS MolecularWeight: 506.818223

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)F)Cl)N)C#N)Br

Isomeric SMILES

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)F)Cl)N)C#N)Br

InChI

InChI=1S/C22H18BrClFN3OS/c1-2-18-13(23)9-19(30-18)20-12(10-26)22(27)28(11-6-7-15(25)14(24)8-11)16-4-3-5-17(29)21(16)20/h6-9,20H,2-5,27H2,1H3