N-[(2S)-2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-phenyl-ethanesulfonamide

Systemtic Name: N-[(2S)-2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-phenyl-ethanesulfonamide Openeye Name: 2-phenyl-N-[(2S)-2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]ethanesulfonamide CAS Name: N-[(2S)-2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-phenylethanesulfonamide IUPAC Name: N-[(2S)-2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]-2-phenylethanesulfonamide Traditional Name: 2-phenyl-N-[(2S)-2-(3-pyridyl)-2-tosyl-ethyl]ethanesulfonamide Formula: C22H24N2O4S2 MolecularWeight: 444.56696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNS(=O)(=O)CCC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H](CNS(=O)(=O)CCC2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C22H24N2O4S2/c1-18-9-11-21(12-10-18)30(27,28)22(20-8-5-14-23-16-20)17-24-29(25,26)15-13-19-6-3-2-4-7-19/h2-12,14,16,22,24H,13,15,17H2,1H3/t22-/m1/s1