(4-fluorophenyl)methyl (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: (4-fluorophenyl)methyl (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enoate Openeye Name: (4-fluorophenyl)methyl (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-2-propenoic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl (E)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]acrylic acid (4-fluorobenzyl) ester Formula: C24H19FN2O2S MolecularWeight: 418.483263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C=CC(=O)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)/C=C/C(=O)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C24H19FN2O2S/c25-21-11-8-19(9-12-21)17-29-23(28)13-10-20-16-27(15-18-5-2-1-3-6-18)26-24(20)22-7-4-14-30-22/h1-14,16H,15,17H2/b13-10+