N-[(2R)-butan-2-yl]-4-[(3S)-3-phenylpiperidin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N-[(2R)-butan-2-yl]-4-[(3S)-3-phenylpiperidin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N-[(1R)-1-methylpropyl]-4-[[(3S)-3-phenyl-1-piperidyl]sulfonyl]benzenesulfonamide CAS Name: N-[(2R)-butan-2-yl]-4-[[(3S)-3-phenyl-1-piperidinyl]sulfonyl]benzenesulfonamide IUPAC Name: N-[(2R)-butan-2-yl]-4-[(3S)-3-phenylpiperidin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-[(1R)-1-methylpropyl]-4-[(3S)-3-phenylpiperidino]sulfonyl-benzenesulfonamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2O4S2/c1-3-17(2)22-28(24,25)20-11-13-21(14-12-20)29(26,27)23-15-7-10-19(16-23)18-8-5-4-6-9-18/h4-6,8-9,11-14,17,19,22H,3,7,10,15-16H2,1-2H3/t17-,19-/m1/s1