4-(azepan-1-ylsulfonyl)-N-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-methyl-benzenesulfonamide CAS Name: 4-(1-azepanylsulfonyl)-N-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-methylbenzenesulfonamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-methyl-benzenesulfonamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H26N2O4S2/c1-21(17-18-9-5-4-6-10-18)27(23,24)19-11-13-20(14-12-19)28(25,26)22-15-7-2-3-8-16-22/h4-6,9-14H,2-3,7-8,15-17H2,1H3