(E)-2-cyano-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(3-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolyl]-N-(2-oxolanylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(3-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]-N-(tetrahydrofurfuryl)acrylamide Formula: C28H29N5O5S MolecularWeight: 547.62536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CC(OC1)CNC(=O)/C(=C/C2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C28H29N5O5S/c29-18-22(28(34)30-19-25-9-5-13-38-25)16-23-20-33(24-7-2-1-3-8-24)31-27(23)21-6-4-10-26(17-21)39(35,36)32-11-14-37-15-12-32/h1-4,6-8,10,16-17,20,25H,5,9,11-15,19H2,(H,30,34)/b22-16+