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

Systemtic Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(2-oxolanylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(tetrahydrofurfuryl)acrylamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCC3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O3/c1-31-22-11-9-18(10-12-22)24-20(17-29(28-24)21-6-3-2-4-7-21)14-19(15-26)25(30)27-16-23-8-5-13-32-23/h2-4,6-7,9-12,14,17,23H,5,8,13,16H2,1H3,(H,27,30)/b19-14+