N-(5-acetamido-2-fluoranyl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-acetamido-2-fluoranyl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-acetamido-2-fluoro-phenyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(5-acetamido-2-fluorophenyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(5-acetamido-2-fluorophenyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-acetamido-2-fluoro-phenyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C19H21FN4O4S MolecularWeight: 420.457843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)F)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)F)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H21FN4O4S/c1-13(25)22-15-4-5-17(20)18(11-15)23-19(26)14-6-9-24(10-7-14)29(27,28)16-3-2-8-21-12-16/h2-5,8,11-12,14H,6-7,9-10H2,1H3,(H,22,25)(H,23,26)