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

Systemtic Name: 2-cyano-3-[3-(4-methoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholin-4-ylethyl)prop-2-enamide Openeye Name: 2-cyano-3-[3-(4-methoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholinoethyl)prop-2-enamide CAS Name: 2-cyano-3-[3-(4-methoxy-3-methylphenyl)-1-phenyl-4-pyrazolyl]-N-[2-(4-morpholinyl)ethyl]-2-propenamide IUPAC Name: 2-cyano-3-[3-(4-methoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-N-(2-morpholin-4-ylethyl)prop-2-enamide Traditional Name: 2-cyano-3-[3-(4-methoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(2-morpholinoethyl)acrylamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCN3CCOCC3)C4=CC=CC=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCN3CCOCC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H29N5O3/c1-20-16-21(8-9-25(20)34-2)26-23(19-32(30-26)24-6-4-3-5-7-24)17-22(18-28)27(33)29-10-11-31-12-14-35-15-13-31/h3-9,16-17,19H,10-15H2,1-2H3,(H,29,33)