2-fluoranyl-N-(3-imidazol-1-ylpropyl)-4-methylsulfonyl-aniline

Systemtic Name: 2-fluoranyl-N-(3-imidazol-1-ylpropyl)-4-methylsulfonyl-aniline Openeye Name: 2-fluoro-N-(3-imidazol-1-ylpropyl)-4-methylsulfonyl-aniline CAS Name: 2-fluoro-N-[3-(1-imidazolyl)propyl]-4-methylsulfonylaniline IUPAC Name: 2-fluoro-N-(3-imidazol-1-ylpropyl)-4-methylsulfonylaniline Traditional Name: (2-fluoro-4-mesyl-phenyl)-(3-imidazol-1-ylpropyl)amine Formula: C13H16FN3O2S MolecularWeight: 297.348443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16FN3O2S/c1-20(18,19)11-3-4-13(12(14)9-11)16-5-2-7-17-8-6-15-10-17/h3-4,6,8-10,16H,2,5,7H2,1H3