(E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acrylamide Formula: C23H27ClN4O2 MolecularWeight: 426.93908

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)C

InChI

InChI=1S/C23H27ClN4O2/c1-4-7-28-16(2)12-18(17(28)3)13-19(15-25)23(29)26-21-14-20(24)5-6-22(21)27-8-10-30-11-9-27/h5-6,12-14H,4,7-11H2,1-3H3,(H,26,29)/b19-13+