4-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-ethyl-N-phenyl-benzamide

Systemtic Name: 4-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-ethyl-N-phenyl-benzamide Openeye Name: 4-[[(3R,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]-N-ethyl-N-phenyl-benzamide CAS Name: 4-[[(3R,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]-N-ethyl-N-phenylbenzamide IUPAC Name: 4-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-ethyl-N-phenylbenzamide Traditional Name: 4-[(3R,5S)-3,5-dimethylpiperidino]sulfonyl-N-ethyl-N-phenyl-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3C[C@@H](C[C@@H](C3)C)C

InChI

InChI=1S/C22H28N2O3S/c1-4-24(20-8-6-5-7-9-20)22(25)19-10-12-21(13-11-19)28(26,27)23-15-17(2)14-18(3)16-23/h5-13,17-18H,4,14-16H2,1-3H3/t17-,18+