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N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(4-ethoxyphenyl)amino]ethanamide
N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(4-ethoxyphenyl)amino]ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
CCOC1=CC=C(C=C1)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3
Isomeric SMILES
CCOC1=CC=C(C=C1)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3
InChI
InChI=1S/C22H29N3O4S/c1-2-29-20-12-10-18(11-13-20)23-17-22(26)24-19-8-7-9-21(16-19)30(27,28)25-14-5-3-4-6-15-25/h7-13,16,23H,2-6,14-15,17H2,1H3,(H,24,26)
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