(E)-2-cyano-N-(4-morpholin-4-ylphenyl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-morpholin-4-ylphenyl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(4-morpholinophenyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-[4-(4-morpholinyl)phenyl]-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-morpholin-4-ylphenyl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(4-morpholinophenyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acrylamide Formula: C28H24N6O2 MolecularWeight: 476.52916

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C(=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)/C(=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C28H24N6O2/c29-18-22(28(35)31-24-8-10-25(11-9-24)33-13-15-36-16-14-33)17-23-20-34(26-6-2-1-3-7-26)32-27(23)21-5-4-12-30-19-21/h1-12,17,19-20H,13-16H2,(H,31,35)/b22-17+