N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-N-methyl-naphthalene-2-sulfonamide

Systemtic Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-N-methyl-naphthalene-2-sulfonamide Openeye Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]-N-methyl-naphthalene-2-sulfonamide CAS Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-N-methyl-2-naphthalenesulfonamide IUPAC Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-N-methylnaphthalene-2-sulfonamide Traditional Name: N-[2-keto-2-(4-p-anisyl-1,4-diazepan-1-yl)ethyl]-N-methyl-naphthalene-2-sulfonamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCN(CC1)CC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN(CC(=O)N1CCCN(CC1)CC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H31N3O4S/c1-27(34(31,32)25-13-10-22-6-3-4-7-23(22)18-25)20-26(30)29-15-5-14-28(16-17-29)19-21-8-11-24(33-2)12-9-21/h3-4,6-13,18H,5,14-17,19-20H2,1-2H3