3-[3-(4-ethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(furan-2-ylmethyl)-2-(phenylsulfonyl)prop-2-enamide

Systemtic Name: 3-[3-(4-ethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(furan-2-ylmethyl)-2-(phenylsulfonyl)prop-2-enamide Openeye Name: 2-(benzenesulfonyl)-3-[3-(4-ethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-furylmethyl)prop-2-enamide CAS Name: 2-(benzenesulfonyl)-3-[3-(4-ethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(2-furanylmethyl)-2-propenamide IUPAC Name: 2-(benzenesulfonyl)-3-[3-(4-ethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(furan-2-ylmethyl)prop-2-enamide Traditional Name: 2-besyl-N-(2-furfuryl)-3-(1-phenyl-3-p-phenetyl-pyrazol-4-yl)acrylamide Formula: C31H27N3O5S MolecularWeight: 553.62818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C(=O)NCC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C(=O)NCC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3O5S/c1-2-38-26-17-15-23(16-18-26)30-24(22-34(33-30)25-10-5-3-6-11-25)20-29(31(35)32-21-27-12-9-19-39-27)40(36,37)28-13-7-4-8-14-28/h3-20,22H,2,21H2,1H3,(H,32,35)