3-chloranyl-4-fluoranyl-5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]aniline

Systemtic Name: 3-chloranyl-4-fluoranyl-5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]aniline Openeye Name: 3-chloro-4-fluoro-5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]aniline CAS Name: 3-chloro-4-fluoro-5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]aniline IUPAC Name: 3-chloro-4-fluoro-5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]aniline Traditional Name: [3-chloro-4-fluoro-5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]phenyl]amine Formula: C12H17ClFN3O2S MolecularWeight: 321.798683

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)S(=O)(=O)C2=C(C(=CC(=C2)N)Cl)F

Isomeric SMILES

CN1CCCN(CC1)S(=O)(=O)C2=C(C(=CC(=C2)N)Cl)F

InChI

InChI=1S/C12H17ClFN3O2S/c1-16-3-2-4-17(6-5-16)20(18,19)11-8-9(15)7-10(13)12(11)14/h7-8H,2-6,15H2,1H3