N,N-diethyl-4-[(2S)-2-pyridin-3-ylpyrrolidin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(2S)-2-pyridin-3-ylpyrrolidin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N,N-diethyl-4-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]sulfonyl-benzenesulfonamide CAS Name: N,N-diethyl-4-[[(2S)-2-(3-pyridinyl)-1-pyrrolidinyl]sulfonyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[(2S)-2-pyridin-3-ylpyrrolidin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N,N-diethyl-4-[(2S)-2-(3-pyridyl)pyrrolidino]sulfonyl-benzenesulfonamide Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=CN=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C3=CN=CC=C3

InChI

InChI=1S/C19H25N3O4S2/c1-3-21(4-2)27(23,24)17-9-11-18(12-10-17)28(25,26)22-14-6-8-19(22)16-7-5-13-20-15-16/h5,7,9-13,15,19H,3-4,6,8,14H2,1-2H3/t19-/m0/s1