N-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methyl-propanediamide

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methyl-propanediamide Openeye Name: N-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-N'-(2-fluorophenyl)-2-methyl-propanediamide CAS Name: N-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methylpropanediamide IUPAC Name: N-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N'-(2-fluorophenyl)-2-methylpropanediamide Traditional Name: N-[(3-bromo-5-methoxy-4-propargyloxy-benzylidene)amino]-N'-(2-fluorophenyl)-2-methyl-malonamide Formula: C21H19BrFN3O4 MolecularWeight: 476.295663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1F)C(=O)NN=CC2=CC(=C(C(=C2)Br)OCC#C)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1F)C(=O)NN=CC2=CC(=C(C(=C2)Br)OCC#C)OC

InChI

InChI=1S/C21H19BrFN3O4/c1-4-9-30-19-15(22)10-14(11-18(19)29-3)12-24-26-21(28)13(2)20(27)25-17-8-6-5-7-16(17)23/h1,5-8,10-13H,9H2,2-3H3,(H,25,27)(H,26,28)