(Z)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (Z)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (Z)-3-[3-(4-allyloxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(3-methoxypropyl)prop-2-enamide CAS Name: (Z)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-prop-2-enoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (Z)-2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-prop-2-enoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (Z)-3-[3-(4-allyloxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(3-methoxypropyl)acrylamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O3/c1-4-14-34-25-12-11-21(16-20(25)2)26-23(19-31(30-26)24-9-6-5-7-10-24)17-22(18-28)27(32)29-13-8-15-33-3/h4-7,9-12,16-17,19H,1,8,13-15H2,2-3H3,(H,29,32)/b22-17-