4-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide CAS Name: 4-(1-azepanylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-o-anisyl-benzenesulfonamide Formula: C27H32N2O5S2 MolecularWeight: 528.68338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC=C1CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H32N2O5S2/c1-34-27-14-8-7-13-24(27)22-29(21-23-11-5-4-6-12-23)36(32,33)26-17-15-25(16-18-26)35(30,31)28-19-9-2-3-10-20-28/h4-8,11-18H,2-3,9-10,19-22H2,1H3