6-[[4-[2-fluoranyl-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]carbamoyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[[4-[2-fluoranyl-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]carbamoyl]pyridine-3-carboxylic acid Openeye Name: 6-[[4-[1-fluoro-2-(isopropylsulfonylamino)-1-methyl-ethyl]phenyl]carbamoyl]pyridine-3-carboxylic acid CAS Name: 6-[[4-[2-fluoro-1-(propan-2-ylsulfonylamino)propan-2-yl]anilino]-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[[4-[2-fluoro-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]carbamoyl]pyridine-3-carboxylic acid Traditional Name: 6-[[4-[1-fluoro-2-(isopropylsulfonylamino)-1-methyl-ethyl]phenyl]carbamoyl]nicotinic acid Formula: C19H22FN3O5S MolecularWeight: 423.458483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCC(C)(C1=CC=C(C=C1)NC(=O)C2=NC=C(C=C2)C(=O)O)F

Isomeric SMILES

CC(C)S(=O)(=O)NCC(C)(C1=CC=C(C=C1)NC(=O)C2=NC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C19H22FN3O5S/c1-12(2)29(27,28)22-11-19(3,20)14-5-7-15(8-6-14)23-17(24)16-9-4-13(10-21-16)18(25)26/h4-10,12,22H,11H2,1-3H3,(H,23,24)(H,25,26)