N-[4-azanyl-3,3-bis(fluoranyl)butyl]-N-(3-azanylpropyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-azanyl-3,3-bis(fluoranyl)butyl]-N-(3-azanylpropyl)-4-methyl-benzenesulfonamide Openeye Name: N-(4-amino-3,3-difluoro-butyl)-N-(3-aminopropyl)-4-methyl-benzenesulfonamide CAS Name: N-(4-amino-3,3-difluorobutyl)-N-(3-aminopropyl)-4-methylbenzenesulfonamide IUPAC Name: N-(4-amino-3,3-difluorobutyl)-N-(3-aminopropyl)-4-methylbenzenesulfonamide Traditional Name: N-(4-amino-3,3-difluoro-butyl)-N-(3-aminopropyl)-4-methyl-benzenesulfonamide Formula: C14H23F2N3O2S MolecularWeight: 335.413126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCN)CCC(CN)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCN)CCC(CN)(F)F

InChI

InChI=1S/C14H23F2N3O2S/c1-12-3-5-13(6-4-12)22(20,21)19(9-2-8-17)10-7-14(15,16)11-18/h3-6H,2,7-11,17-18H2,1H3