(E)-3-[1-(3-bromanyl-4-morpholin-4-yl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-prop-2-enamide

Systemtic Name: (E)-3-[1-(3-bromanyl-4-morpholin-4-yl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-prop-2-enamide Openeye Name: (E)-3-[1-(3-bromo-4-morpholino-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-prop-2-enamide CAS Name: (E)-3-[1-[3-bromo-4-(4-morpholinyl)phenyl]-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-cyclohexyl-2-propenamide IUPAC Name: (E)-3-[1-(3-bromo-4-morpholin-4-ylphenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-cyclohexylprop-2-enamide Traditional Name: (E)-3-[1-(3-bromo-4-morpholino-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-acrylamide Formula: C26H31BrN4O2 MolecularWeight: 511.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)Br)C)C=C(C#N)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)Br)C)/C=C(\C#N)/C(=O)NC4CCCCC4

InChI

InChI=1S/C26H31BrN4O2/c1-18-14-20(15-21(17-28)26(32)29-22-6-4-3-5-7-22)19(2)31(18)23-8-9-25(24(27)16-23)30-10-12-33-13-11-30/h8-9,14-16,22H,3-7,10-13H2,1-2H3,(H,29,32)/b21-15+