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

Systemtic Name: 2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: 2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: 2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-propoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: 2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-propoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: 2-cyano-N-(3-methoxypropyl)-3-[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCOC)C3=CC=CC=C3)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCOC)C3=CC=CC=C3)C

InChI

InChI=1S/C27H30N4O3/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/h5-7,9-12,16-17,19H,4,8,13-15H2,1-3H3,(H,29,32)