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

Systemtic Name: 2-[3,5-bis(fluoranyl)phenyl]sulfonyl-N-methyl-5-(4-methyl-1,4-diazepan-1-yl)aniline Openeye Name: 2-(3,5-difluorophenyl)sulfonyl-N-methyl-5-(4-methyl-1,4-diazepan-1-yl)aniline CAS Name: 2-(3,5-difluorophenyl)sulfonyl-N-methyl-5-(4-methyl-1,4-diazepan-1-yl)aniline IUPAC Name: 2-(3,5-difluorophenyl)sulfonyl-N-methyl-5-(4-methyl-1,4-diazepan-1-yl)aniline Traditional Name: [2-(3,5-difluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-methyl-amine Formula: C19H23F2N3O2S MolecularWeight: 395.466626

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC(=CC(=C3)F)F

Isomeric SMILES

CNC1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC(=CC(=C3)F)F

InChI

InChI=1S/C19H23F2N3O2S/c1-22-18-13-16(24-7-3-6-23(2)8-9-24)4-5-19(18)27(25,26)17-11-14(20)10-15(21)12-17/h4-5,10-13,22H,3,6-9H2,1-2H3