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

Systemtic Name: N-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N'-(4-methoxyphenyl)-2-methyl-propanediamide Openeye Name: N-[(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-N'-(4-methoxyphenyl)-2-methyl-propanediamide CAS Name: N-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N'-(4-methoxyphenyl)-2-methylpropanediamide IUPAC Name: N-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N'-(4-methoxyphenyl)-2-methylpropanediamide Traditional Name: N-[(5-bromo-2-propargyloxy-benzylidene)amino]-N'-(4-methoxyphenyl)-2-methyl-malonamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)C(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC)C(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C

InChI

InChI=1S/C21H20BrN3O4/c1-4-11-29-19-10-5-16(22)12-15(19)13-23-25-21(27)14(2)20(26)24-17-6-8-18(28-3)9-7-17/h1,5-10,12-14H,11H2,2-3H3,(H,24,26)(H,25,27)