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2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(2,6-dimethylphenyl)ethanamide
2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(2,6-dimethylphenyl)ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C(=CC=C1)C)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3
Isomeric SMILES
CC1=C(C(=CC=C1)C)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3
InChI
InChI=1S/C22H29N3O3S/c1-17-8-7-9-18(2)22(17)24-21(26)16-23-19-10-12-20(13-11-19)29(27,28)25-14-5-3-4-6-15-25/h7-13,23H,3-6,14-16H2,1-2H3,(H,24,26)
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