3-bromanyl-4-methoxy-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]benzenesulfonamide Openeye Name: 3-bromo-4-methoxy-N-[(1S)-2-morpholino-1-(p-tolyl)ethyl]benzenesulfonamide CAS Name: 3-bromo-4-methoxy-N-[(1S)-1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]benzenesulfonamide IUPAC Name: 3-bromo-4-methoxy-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]benzenesulfonamide Traditional Name: 3-bromo-4-methoxy-N-[(1S)-2-morpholino-1-(p-tolyl)ethyl]benzenesulfonamide Formula: C20H25BrN2O4S MolecularWeight: 469.3925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCOCC2)NS(=O)(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](CN2CCOCC2)NS(=O)(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C20H25BrN2O4S/c1-15-3-5-16(6-4-15)19(14-23-9-11-27-12-10-23)22-28(24,25)17-7-8-20(26-2)18(21)13-17/h3-8,13,19,22H,9-12,14H2,1-2H3/t19-/m1/s1