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

Systemtic Name: (E)-2-cyano-N-(4-morpholin-4-ylphenyl)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-2-cyano-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[4-(4-morpholinyl)phenyl]-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-phenylpyrazol-4-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-2-cyano-N-(4-morpholinophenyl)acrylamide Formula: C30H27N5O2 MolecularWeight: 489.56768

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C(=CC3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5)C#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)/C(=C/C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5)/C#N

InChI

InChI=1S/C30H27N5O2/c31-20-25(30(36)32-27-11-13-28(14-12-27)34-15-17-37-18-16-34)19-26-22-35(21-23-7-3-1-4-8-23)33-29(26)24-9-5-2-6-10-24/h1-14,19,22H,15-18,21H2,(H,32,36)/b25-19+