2-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline Openeye Name: 2-(3,4-difluorophenyl)sulfonyl-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline CAS Name: 2-(3,4-difluorophenyl)sulfonyl-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline IUPAC Name: 2-(3,4-difluorophenyl)sulfonyl-N-ethyl-5-(4-methyl-1,4-diazepan-1-yl)aniline Traditional Name: [2-(3,4-difluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-ethyl-amine Formula: C20H25F2N3O2S MolecularWeight: 409.493206

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CCNC1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C20H25F2N3O2S/c1-3-23-19-13-15(25-10-4-9-24(2)11-12-25)5-8-20(19)28(26,27)16-6-7-17(21)18(22)14-16/h5-8,13-14,23H,3-4,9-12H2,1-2H3