3-cyano-N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonylphenyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonylphenyl]benzenesulfonamide Openeye Name: 3-cyano-N-[2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]benzenesulfonamide CAS Name: 3-cyano-N-[2-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]benzenesulfonamide Traditional Name: 3-cyano-N-[2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]benzenesulfonamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H21N3O4S/c1-14-12-23(13-15(2)27-14)20(24)18-8-3-4-9-19(18)22-28(25,26)17-7-5-6-16(10-17)11-21/h3-10,14-15,22H,12-13H2,1-2H3/t14-,15-/m0/s1