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N-[2-[(2-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethyl]benzenesulfonamide
N-[2-[(2-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethyl]benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC2=C(C=C1)OCC3=CC=CC=C3C2SCCNS(=O)(=O)C4=CC=CC=C4
Isomeric SMILES
CC1=CC2=C(C=C1)OCC3=CC=CC=C3C2SCCNS(=O)(=O)C4=CC=CC=C4
InChI
InChI=1S/C23H23NO3S2/c1-17-11-12-22-21(15-17)23(20-10-6-5-7-18(20)16-27-22)28-14-13-24-29(25,26)19-8-3-2-4-9-19/h2-12,15,23-24H,13-14,16H2,1H3
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