N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[methyl(methylsulfonyl)amino]benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[methyl(methylsulfonyl)amino]benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[methyl(methylsulfonyl)amino]benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-[methyl(methylsulfonyl)amino]benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[methyl(methylsulfonyl)amino]benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[mesyl(methyl)amino]benzamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O5S2/c1-23(30(2,26)27)20-10-6-5-9-19(20)21(25)22-17-11-13-18(14-12-17)31(28,29)24-15-7-3-4-8-16-24/h5-6,9-14H,3-4,7-8,15-16H2,1-2H3,(H,22,25)