N-(2-fluoranyl-5-methylsulfonyl-phenyl)-1-prop-2-ynyl-piperidin-4-amine

Systemtic Name: N-(2-fluoranyl-5-methylsulfonyl-phenyl)-1-prop-2-ynyl-piperidin-4-amine Openeye Name: N-(2-fluoro-5-methylsulfonyl-phenyl)-1-prop-2-ynyl-piperidin-4-amine CAS Name: N-(2-fluoro-5-methylsulfonylphenyl)-1-prop-2-ynyl-4-piperidinamine IUPAC Name: N-(2-fluoro-5-methylsulfonylphenyl)-1-prop-2-ynylpiperidin-4-amine Traditional Name: (2-fluoro-5-mesyl-phenyl)-(1-propargyl-4-piperidyl)amine Formula: C15H19FN2O2S MolecularWeight: 310.386963

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)F)NC2CCN(CC2)CC#C

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)NC2CCN(CC2)CC#C

InChI

InChI=1S/C15H19FN2O2S/c1-3-8-18-9-6-12(7-10-18)17-15-11-13(21(2,19)20)4-5-14(15)16/h1,4-5,11-12,17H,6-10H2,2H3