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

Systemtic Name: N-(furan-2-ylmethyl)-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-2-(phenylsulfonyl)prop-2-enamide Openeye Name: 2-(benzenesulfonyl)-N-(2-furylmethyl)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-enamide CAS Name: 2-(benzenesulfonyl)-N-(2-furanylmethyl)-3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: 2-(benzenesulfonyl)-N-(furan-2-ylmethyl)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: 2-besyl-N-(2-furfuryl)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]acrylamide Formula: C30H25N3O4S MolecularWeight: 523.6022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=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

CC1=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/C30H25N3O4S/c1-22-14-16-23(17-15-22)29-24(21-33(32-29)25-9-4-2-5-10-25)19-28(30(34)31-20-26-11-8-18-37-26)38(35,36)27-12-6-3-7-13-27/h2-19,21H,20H2,1H3,(H,31,34)