N-[(4-fluoranyl-2-methylsulfonyl-phenyl)methyl]-6-pyrrolidin-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[(4-fluoranyl-2-methylsulfonyl-phenyl)methyl]-6-pyrrolidin-1-yl-pyridine-3-carboxamide Openeye Name: N-[(4-fluoro-2-methylsulfonyl-phenyl)methyl]-6-pyrrolidin-1-yl-pyridine-3-carboxamide CAS Name: N-[(4-fluoro-2-methylsulfonylphenyl)methyl]-6-(1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-[(4-fluoro-2-methylsulfonylphenyl)methyl]-6-pyrrolidin-1-ylpyridine-3-carboxamide Traditional Name: N-(4-fluoro-2-mesyl-benzyl)-6-pyrrolidino-nicotinamide Formula: C18H20FN3O3S MolecularWeight: 377.433103

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)CNC(=O)C2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)CNC(=O)C2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C18H20FN3O3S/c1-26(24,25)16-10-15(19)6-4-13(16)11-21-18(23)14-5-7-17(20-12-14)22-8-2-3-9-22/h4-7,10,12H,2-3,8-9,11H2,1H3,(H,21,23)