4-methoxy-N-[(2S)-2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[(2S)-2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]benzenesulfonamide Openeye Name: N-[(2S)-2-(benzenesulfonyl)-2-(3-pyridyl)ethyl]-4-methoxy-benzenesulfonamide CAS Name: N-[(2S)-2-(benzenesulfonyl)-2-(3-pyridinyl)ethyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-4-methoxybenzenesulfonamide Traditional Name: N-[(2S)-2-besyl-2-(3-pyridyl)ethyl]-4-methoxy-benzenesulfonamide Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC[C@H](C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O5S2/c1-27-17-9-11-19(12-10-17)29(25,26)22-15-20(16-6-5-13-21-14-16)28(23,24)18-7-3-2-4-8-18/h2-14,20,22H,15H2,1H3/t20-/m1/s1