4-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]-N-phenyl-benzenesulfonamide Openeye Name: 4-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]-N-phenyl-benzenesulfonamide CAS Name: 4-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]-N-phenylbenzenesulfonamide IUPAC Name: 4-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]-N-phenylbenzenesulfonamide Traditional Name: 4-(4-p-anisyl-1,4-diazepane-1-carbonyl)-N-phenyl-benzenesulfonamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4S/c1-33-24-12-8-21(9-13-24)20-28-16-5-17-29(19-18-28)26(30)22-10-14-25(15-11-22)34(31,32)27-23-6-3-2-4-7-23/h2-4,6-15,27H,5,16-20H2,1H3