(E)-1-(4-methylsulfonylphenyl)-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-methylsulfonylphenyl)-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-methylsulfonylphenyl)-3-[2-(1-piperidylmethyl)pyrrolidin-1-yl]prop-2-en-1-one CAS Name: (E)-1-(4-methylsulfonylphenyl)-3-[2-(1-piperidinylmethyl)-1-pyrrolidinyl]-2-propen-1-one IUPAC Name: (E)-1-(4-methylsulfonylphenyl)-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-2-en-1-one Traditional Name: (E)-1-(4-mesylphenyl)-3-[2-(piperidinomethyl)pyrrolidino]prop-2-en-1-one Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C=CN2CCCC2CN3CCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/N2CCCC2CN3CCCCC3

InChI

InChI=1S/C20H28N2O3S/c1-26(24,25)19-9-7-17(8-10-19)20(23)11-15-22-14-5-6-18(22)16-21-12-3-2-4-13-21/h7-11,15,18H,2-6,12-14,16H2,1H3/b15-11+