(E)-2-cyano-3-[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholin-4-ylethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholin-4-ylethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholinoethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-4-pyrazolyl]-N-[2-(4-morpholinyl)ethyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-N-(2-morpholin-4-ylethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholinoethyl)acrylamide Formula: C28H31N5O3 MolecularWeight: 485.57744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCN3CCOCC3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCCN3CCOCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H31N5O3/c1-3-36-26-10-9-22(17-21(26)2)27-24(20-33(31-27)25-7-5-4-6-8-25)18-23(19-29)28(34)30-11-12-32-13-15-35-16-14-32/h4-10,17-18,20H,3,11-16H2,1-2H3,(H,30,34)/b23-18+