(Z)-2-cyano-N-(furan-2-ylmethyl)-3-[1-phenyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (Z)-2-cyano-N-(furan-2-ylmethyl)-3-[1-phenyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (Z)-2-cyano-N-(2-furylmethyl)-3-[1-phenyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enamide CAS Name: (Z)-2-cyano-N-(2-furanylmethyl)-3-[1-phenyl-3-[3-(1-pyrrolidinylsulfonyl)phenyl]-4-pyrazolyl]-2-propenamide IUPAC Name: (Z)-2-cyano-N-(furan-2-ylmethyl)-3-[1-phenyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enamide Traditional Name: (Z)-2-cyano-N-(2-furfuryl)-3-[1-phenyl-3-(3-pyrrolidinosulfonylphenyl)pyrazol-4-yl]acrylamide Formula: C28H25N5O4S MolecularWeight: 527.5942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3C=C(C#N)C(=O)NCC4=CC=CO4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3/C=C(/C#N)\C(=O)NCC4=CC=CO4)C5=CC=CC=C5

InChI

InChI=1S/C28H25N5O4S/c29-18-22(28(34)30-19-25-11-7-15-37-25)16-23-20-33(24-9-2-1-3-10-24)31-27(23)21-8-6-12-26(17-21)38(35,36)32-13-4-5-14-32/h1-3,6-12,15-17,20H,4-5,13-14,19H2,(H,30,34)/b22-16-