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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfonyl-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfonyl-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-methylsulfonylbenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfonylbenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-mesyl-benzamide Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H24N2O5S2/c1-28(24,25)18-10-6-16(7-11-18)20(23)21-17-8-12-19(13-9-17)29(26,27)22-14-4-2-3-5-15-22/h6-13H,2-5,14-15H2,1H3,(H,21,23)