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

Systemtic Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methylphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCOC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCCCOC)C3=CC=CC=C3

InChI

InChI=1S/C24H24N4O2/c1-18-8-6-9-19(14-18)23-21(17-28(27-23)22-10-4-3-5-11-22)15-20(16-25)24(29)26-12-7-13-30-2/h3-6,8-11,14-15,17H,7,12-13H2,1-2H3,(H,26,29)/b20-15+