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

Systemtic Name: (E)-N-(3-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-2-morpholino-phenyl)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-[3-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-propenamide IUPAC Name: (E)-N-(3-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-N-(3-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/c1-4-8-28-16(2)13-18(17(28)3)14-19(15-25)23(29)26-21-7-5-6-20(24)22(21)27-9-11-30-12-10-27/h5-7,13-14H,4,8-12H2,1-3H3,(H,26,29)/b19-14+