(Z)-3-[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide

Systemtic Name: (Z)-3-[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide Openeye Name: (Z)-3-[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide CAS Name: (Z)-3-[3-(3-butoxyphenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-(2-oxolanylmethyl)-2-propenamide IUPAC Name: (Z)-3-[3-(3-butoxyphenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide Traditional Name: (Z)-3-[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(tetrahydrofurfuryl)acrylamide Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)NCC3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O3/c1-2-3-14-34-25-12-7-9-21(17-25)27-23(20-32(31-27)24-10-5-4-6-11-24)16-22(18-29)28(33)30-19-26-13-8-15-35-26/h4-7,9-12,16-17,20,26H,2-3,8,13-15,19H2,1H3,(H,30,33)/b22-16-