(E)-2-cyano-N-(3-ethoxypropyl)-3-[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-ethoxypropyl)-3-[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-ethoxypropyl)-3-[3-(o-tolyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3-ethoxypropyl)-3-[3-(2-methylphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-ethoxypropyl)-3-[3-(2-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-ethoxypropyl)-3-[3-(o-tolyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2C)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOCCCNC(=O)/C(=C/C1=CN(N=C1C2=CC=CC=C2C)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C25H26N4O2/c1-3-31-15-9-14-27-25(30)20(17-26)16-21-18-29(22-11-5-4-6-12-22)28-24(21)23-13-8-7-10-19(23)2/h4-8,10-13,16,18H,3,9,14-15H2,1-2H3,(H,27,30)/b20-16+