2-(4-bromanyl-2-fluoranyl-phenoxy)-N-[3-cyano-4,5-dimethyl-1-(phenylmethyl)pyrrol-2-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenoxy)-N-[3-cyano-4,5-dimethyl-1-(phenylmethyl)pyrrol-2-yl]ethanamide Openeye Name: N-(1-benzyl-3-cyano-4,5-dimethyl-pyrrol-2-yl)-2-(4-bromo-2-fluoro-phenoxy)acetamide CAS Name: 2-(4-bromo-2-fluorophenoxy)-N-[3-cyano-4,5-dimethyl-1-(phenylmethyl)-2-pyrrolyl]acetamide IUPAC Name: N-(1-benzyl-3-cyano-4,5-dimethylpyrrol-2-yl)-2-(4-bromo-2-fluorophenoxy)acetamide Traditional Name: N-(1-benzyl-3-cyano-4,5-dimethyl-pyrrol-2-yl)-2-(4-bromo-2-fluoro-phenoxy)acetamide Formula: C22H19BrFN3O2 MolecularWeight: 456.307563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)COC2=C(C=C(C=C2)Br)F)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)COC2=C(C=C(C=C2)Br)F)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H19BrFN3O2/c1-14-15(2)27(12-16-6-4-3-5-7-16)22(18(14)11-25)26-21(28)13-29-20-9-8-17(23)10-19(20)24/h3-10H,12-13H2,1-2H3,(H,26,28)