4-[(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[(E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[(E)-3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[(E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[(E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acryloyl]-N,N-diethyl-benzenesulfonamide Formula: C30H27N3O4S MolecularWeight: 525.61808

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C30H27N3O4S/c1-3-32(4-2)38(35,36)26-17-14-22(15-18-26)27(34)19-16-24-21-33(25-11-6-5-7-12-25)31-30(24)29-20-23-10-8-9-13-28(23)37-29/h5-21H,3-4H2,1-2H3/b19-16+