(E)-3-(4-bromophenyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(4-bromophenyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-bromophenyl)-N-[4-(2-furylmethylcarbamoylamino)phenyl]prop-2-enamide CAS Name: (E)-3-(4-bromophenyl)-N-[4-[[(2-furanylmethylamino)-oxomethyl]amino]phenyl]-2-propenamide IUPAC Name: (E)-3-(4-bromophenyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-bromophenyl)-N-[4-(2-furfurylcarbamoylamino)phenyl]acrylamide Formula: C21H18BrN3O3 MolecularWeight: 440.28992

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)NC2=CC=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)CNC(=O)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O3/c22-16-6-3-15(4-7-16)5-12-20(26)24-17-8-10-18(11-9-17)25-21(27)23-14-19-2-1-13-28-19/h1-13H,14H2,(H,24,26)(H2,23,25,27)/b12-5+