3-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]-piperidin-4-yl-sulfamoyl]propyl-(2-hydroxyethyl)-dimethyl-azanium

Systemtic Name: 3-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]-piperidin-4-yl-sulfamoyl]propyl-(2-hydroxyethyl)-dimethyl-azanium Openeye Name: 3-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]-(4-piperidyl)sulfamoyl]propyl-(2-hydroxyethyl)-dimethyl-ammonium CAS Name: 3-[[4-amino-5-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-2-pyrimidinyl]-(4-piperidinyl)sulfamoyl]propyl-(2-hydroxyethyl)-dimethylammonium IUPAC Name: 3-[[4-amino-5-(5-fluoro-2-methoxybenzoyl)pyrimidin-2-yl]-piperidin-4-ylsulfamoyl]propyl-(2-hydroxyethyl)-dimethylazanium Traditional Name: 3-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]-(4-piperidyl)sulfamoyl]propyl-(2-hydroxyethyl)-dimethyl-ammonium Formula: C24H36FN6O5S+ MolecularWeight: 539.643243

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCS(=O)(=O)N(C1CCNCC1)C2=NC=C(C(=N2)N)C(=O)C3=C(C=CC(=C3)F)OC)CCO

Isomeric SMILES

C[N+](C)(CCCS(=O)(=O)N(C1CCNCC1)C2=NC=C(C(=N2)N)C(=O)C3=C(C=CC(=C3)F)OC)CCO

InChI

InChI=1S/C24H35FN6O5S/c1-31(2,12-13-32)11-4-14-37(34,35)30(18-7-9-27-10-8-18)24-28-16-20(23(26)29-24)22(33)19-15-17(25)5-6-21(19)36-3/h5-6,15-16,18,27,32H,4,7-14H2,1-3H3,(H-,26,28,29,33)/p+1