(E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C23H20ClN5O2 MolecularWeight: 433.8902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)C(=CC3=CN(N=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)/C(=C/C3=CN(N=C3)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C23H20ClN5O2/c24-19-6-7-22(28-8-10-31-11-9-28)21(13-19)27-23(30)18(14-25)12-17-15-26-29(16-17)20-4-2-1-3-5-20/h1-7,12-13,15-16H,8-11H2,(H,27,30)/b18-12+