(E)-3-[2-(pyridin-2-ylmethoxy)phenyl]-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[2-(pyridin-2-ylmethoxy)phenyl]-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[2-(2-pyridylmethoxy)phenyl]-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-[2-(2-pyridinylmethoxy)phenyl]-1-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[2-(pyridin-2-ylmethoxy)phenyl]-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[2-(2-pyridylmethoxy)phenyl]-1-(4-pyrrolidinosulfonylphenyl)prop-2-en-1-one Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C=CC3=CC=CC=C3OCC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)/C=C/C3=CC=CC=C3OCC4=CC=CC=N4

InChI

InChI=1S/C25H24N2O4S/c28-24(20-10-13-23(14-11-20)32(29,30)27-17-5-6-18-27)15-12-21-7-1-2-9-25(21)31-19-22-8-3-4-16-26-22/h1-4,7-16H,5-6,17-19H2/b15-12+