4-fluoranyl-N-methyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-methyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxo-ethyl]-4-fluoro-N-methyl-benzenesulfonamide CAS Name: 4-fluoro-N-methyl-N-[2-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxoethyl]-4-fluoro-N-methylbenzenesulfonamide Traditional Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]-4-fluoro-N-methyl-benzenesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCN(CC1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC(=O)N1CCCN(CC1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O3S/c1-23(29(27,28)20-10-8-19(22)9-11-20)17-21(26)25-13-5-12-24(14-15-25)16-18-6-3-2-4-7-18/h2-4,6-11H,5,12-17H2,1H3