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

Systemtic Name: (E)-2-cyano-N-(4-ethoxyphenyl)-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(4-ethoxyphenyl)-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(4-ethoxyphenyl)-3-[1-phenyl-3-(4-propoxyphenyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-ethoxyphenyl)-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]-N-p-phenetyl-acrylamide Formula: C30H28N4O3 MolecularWeight: 492.56832

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3=CC=C(C=C3)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)OCC)C4=CC=CC=C4

InChI

InChI=1S/C30H28N4O3/c1-3-18-37-28-14-10-22(11-15-28)29-24(21-34(33-29)26-8-6-5-7-9-26)19-23(20-31)30(35)32-25-12-16-27(17-13-25)36-4-2/h5-17,19,21H,3-4,18H2,1-2H3,(H,32,35)/b23-19+