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

Systemtic Name: N-[4-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]phenyl]methanesulfonamide Openeye Name: N-[4-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-(4-p-anisyl-1,4-diazepane-1-carbonyl)phenyl]methanesulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C21H27N3O4S/c1-28-20-10-4-17(5-11-20)16-23-12-3-13-24(15-14-23)21(25)18-6-8-19(9-7-18)22-29(2,26)27/h4-11,22H,3,12-16H2,1-2H3