N-[4-(azepan-1-ylsulfonyl)phenyl]-2-methyl-3-(phenylsulfonylamino)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-methyl-3-(phenylsulfonylamino)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(benzenesulfonamido)-2-methyl-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-(benzenesulfonamido)-2-methylbenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(benzenesulfonamido)-2-methylbenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(benzenesulfonamido)-2-methyl-benzamide Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H29N3O5S2/c1-20-24(12-9-13-25(20)28-35(31,32)22-10-5-4-6-11-22)26(30)27-21-14-16-23(17-15-21)36(33,34)29-18-7-2-3-8-19-29/h4-6,9-17,28H,2-3,7-8,18-19H2,1H3,(H,27,30)