5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[3-[mesyl(methyl)amino]phenyl]benzamide Formula: C21H26ClN3O5S2 MolecularWeight: 500.03124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26ClN3O5S2/c1-24(31(2,27)28)17-9-7-8-16(14-17)23-21(26)19-15-18(10-11-20(19)22)32(29,30)25-12-5-3-4-6-13-25/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,23,26)