2-[bis(fluoranyl)methylsulfonyl]-N-(3-imidazol-1-ylpropyl)aniline

Systemtic Name: 2-[bis(fluoranyl)methylsulfonyl]-N-(3-imidazol-1-ylpropyl)aniline Openeye Name: 2-(difluoromethylsulfonyl)-N-(3-imidazol-1-ylpropyl)aniline CAS Name: 2-(difluoromethylsulfonyl)-N-[3-(1-imidazolyl)propyl]aniline IUPAC Name: 2-(difluoromethylsulfonyl)-N-(3-imidazol-1-ylpropyl)aniline Traditional Name: [2-(difluoromethylsulfonyl)phenyl]-(3-imidazol-1-ylpropyl)amine Formula: C13H15F2N3O2S MolecularWeight: 315.338906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCCN2C=CN=C2)S(=O)(=O)C(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NCCCN2C=CN=C2)S(=O)(=O)C(F)F

InChI

InChI=1S/C13H15F2N3O2S/c14-13(15)21(19,20)12-5-2-1-4-11(12)17-6-3-8-18-9-7-16-10-18/h1-2,4-5,7,9-10,13,17H,3,6,8H2