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N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(3-methoxyphenyl)amino]ethanamide
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(3-methoxyphenyl)amino]ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=CC(=C1)NCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3
Isomeric SMILES
COC1=CC=CC(=C1)NCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3
InChI
InChI=1S/C21H27N3O4S/c1-28-19-8-6-7-18(15-19)22-16-21(25)23-17-9-11-20(12-10-17)29(26,27)24-13-4-2-3-5-14-24/h6-12,15,22H,2-5,13-14,16H2,1H3,(H,23,25)
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