(E)-3-[1-(4-bromanylnaphthalen-1-yl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-[1-(4-bromanylnaphthalen-1-yl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-[1-(4-bromo-1-naphthyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(2-thienylmethyl)prop-2-enamide CAS Name: (E)-3-[1-(4-bromo-1-naphthalenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-(thiophen-2-ylmethyl)-2-propenamide IUPAC Name: (E)-3-[1-(4-bromonaphthalen-1-yl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide Traditional Name: (E)-3-[1-(4-bromo-1-naphthyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(2-thenyl)acrylamide Formula: C25H20BrN3OS MolecularWeight: 490.4148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C3=CC=CC=C32)Br)C)C=C(C#N)C(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C3=CC=CC=C32)Br)C)/C=C(\C#N)/C(=O)NCC4=CC=CS4

InChI

InChI=1S/C25H20BrN3OS/c1-16-12-18(13-19(14-27)25(30)28-15-20-6-5-11-31-20)17(2)29(16)24-10-9-23(26)21-7-3-4-8-22(21)24/h3-13H,15H2,1-2H3,(H,28,30)/b19-13+