(E)-4-[1-[(4-bromophenyl)methyl]indol-3-yl]-2-cyano-N-(furan-2-ylmethyl)but-2-enamide

Systemtic Name: (E)-4-[1-[(4-bromophenyl)methyl]indol-3-yl]-2-cyano-N-(furan-2-ylmethyl)but-2-enamide Openeye Name: (E)-4-[1-[(4-bromophenyl)methyl]indol-3-yl]-2-cyano-N-(2-furylmethyl)but-2-enamide CAS Name: (E)-4-[1-[(4-bromophenyl)methyl]-3-indolyl]-2-cyano-N-(2-furanylmethyl)-2-butenamide IUPAC Name: (E)-4-[1-[(4-bromophenyl)methyl]indol-3-yl]-2-cyano-N-(furan-2-ylmethyl)but-2-enamide Traditional Name: (E)-4-[1-(4-bromobenzyl)indol-3-yl]-2-cyano-N-(2-furfuryl)but-2-enamide Formula: C25H20BrN3O2 MolecularWeight: 474.3492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Br)CC=C(C#N)C(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Br)C/C=C(\C#N)/C(=O)NCC4=CC=CO4

InChI

InChI=1S/C25H20BrN3O2/c26-21-11-7-18(8-12-21)16-29-17-20(23-5-1-2-6-24(23)29)10-9-19(14-27)25(30)28-15-22-4-3-13-31-22/h1-9,11-13,17H,10,15-16H2,(H,28,30)/b19-9+