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

Systemtic Name: N-[(2S)-2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]-4-propan-2-yl-benzenesulfonamide Openeye Name: N-[(2S)-2-(benzenesulfonyl)-2-(3-pyridyl)ethyl]-4-isopropyl-benzenesulfonamide CAS Name: N-[(2S)-2-(benzenesulfonyl)-2-(3-pyridinyl)ethyl]-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-4-propan-2-ylbenzenesulfonamide Traditional Name: N-[(2S)-2-besyl-2-(3-pyridyl)ethyl]-4-isopropyl-benzenesulfonamide Formula: C22H24N2O4S2 MolecularWeight: 444.56696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4S2/c1-17(2)18-10-12-21(13-11-18)30(27,28)24-16-22(19-7-6-14-23-15-19)29(25,26)20-8-4-3-5-9-20/h3-15,17,22,24H,16H2,1-2H3/t22-/m1/s1