(E)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-3-[4-(2-ketopyrrolidino)phenyl]acrylamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C=CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)/C=C/C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C26H31N3O5S/c1-2-34-24-14-13-22(35(32,33)28-16-4-3-5-17-28)19-23(24)27-25(30)15-10-20-8-11-21(12-9-20)29-18-6-7-26(29)31/h8-15,19H,2-7,16-18H2,1H3,(H,27,30)/b15-10+