N-[(5-bromanyl-2-propoxy-phenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methyl-propanediamide

Systemtic Name: N-[(5-bromanyl-2-propoxy-phenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methyl-propanediamide Openeye Name: N-[(5-bromo-2-propoxy-phenyl)methyleneamino]-N'-(2-fluorophenyl)-2-methyl-propanediamide CAS Name: N-[(5-bromo-2-propoxyphenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methylpropanediamide IUPAC Name: N-[(5-bromo-2-propoxyphenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methylpropanediamide Traditional Name: N-[(5-bromo-2-propoxy-benzylidene)amino]-N'-(2-fluorophenyl)-2-methyl-malonamide Formula: C20H21BrFN3O3 MolecularWeight: 450.301443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C=NNC(=O)C(C)C(=O)NC2=CC=CC=C2F

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C=NNC(=O)C(C)C(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C20H21BrFN3O3/c1-3-10-28-18-9-8-15(21)11-14(18)12-23-25-20(27)13(2)19(26)24-17-7-5-4-6-16(17)22/h4-9,11-13H,3,10H2,1-2H3,(H,24,26)(H,25,27)