(E)-N'-(3-bromanyl-4-fluoranyl-phenyl)-3-cyano-4-(dimethylamino)-N-quinolin-6-yl-but-2-enehydrazide

Systemtic Name: (E)-N'-(3-bromanyl-4-fluoranyl-phenyl)-3-cyano-4-(dimethylamino)-N-quinolin-6-yl-but-2-enehydrazide Openeye Name: (E)-N'-(3-bromo-4-fluoro-phenyl)-3-cyano-4-(dimethylamino)-N-(6-quinolyl)but-2-enehydrazide CAS Name: (E)-N'-(3-bromo-4-fluorophenyl)-3-cyano-4-(dimethylamino)-N-(6-quinolinyl)-2-butenehydrazide IUPAC Name: (E)-N'-(3-bromo-4-fluorophenyl)-3-cyano-4-(dimethylamino)-N-quinolin-6-ylbut-2-enehydrazide Traditional Name: (E)-N'-(3-bromo-4-fluoro-phenyl)-3-cyano-4-(dimethylamino)-N-(6-quinolyl)but-2-enohydrazide Formula: C22H19BrFN5O MolecularWeight: 468.321563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(=CC(=O)N(C1=CC2=C(C=C1)N=CC=C2)NC3=CC(=C(C=C3)F)Br)C#N

Isomeric SMILES

CN(C)C/C(=C\C(=O)N(C1=CC2=C(C=C1)N=CC=C2)NC3=CC(=C(C=C3)F)Br)/C#N

InChI

InChI=1S/C22H19BrFN5O/c1-28(2)14-15(13-25)10-22(30)29(27-17-5-7-20(24)19(23)12-17)18-6-8-21-16(11-18)4-3-9-26-21/h3-12,27H,14H2,1-2H3/b15-10-