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

Systemtic Name: 2-[3,5-bis(fluoranyl)phenyl]sulfonyl-5-(1,4-diazepan-1-yl)aniline Openeye Name: 5-(1,4-diazepan-1-yl)-2-(3,5-difluorophenyl)sulfonyl-aniline CAS Name: 5-(1,4-diazepan-1-yl)-2-(3,5-difluorophenyl)sulfonylaniline IUPAC Name: 5-(1,4-diazepan-1-yl)-2-(3,5-difluorophenyl)sulfonylaniline Traditional Name: [5-(1,4-diazepan-1-yl)-2-(3,5-difluorophenyl)sulfonyl-phenyl]amine Formula: C17H19F2N3O2S MolecularWeight: 367.413466

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)S(=O)(=O)C3=CC(=CC(=C3)F)F)N

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)S(=O)(=O)C3=CC(=CC(=C3)F)F)N

InChI

InChI=1S/C17H19F2N3O2S/c18-12-8-13(19)10-15(9-12)25(23,24)17-3-2-14(11-16(17)20)22-6-1-4-21-5-7-22/h2-3,8-11,21H,1,4-7,20H2