5-fluoranyl-2-(3-methylsulfanylphenoxy)-N-[4-(propanoylamino)cyclohexyl]pyridine-3-carboxamide

Systemtic Name: 5-fluoranyl-2-(3-methylsulfanylphenoxy)-N-[4-(propanoylamino)cyclohexyl]pyridine-3-carboxamide Openeye Name: 5-fluoro-2-(3-methylsulfanylphenoxy)-N-[4-(propanoylamino)cyclohexyl]pyridine-3-carboxamide CAS Name: 5-fluoro-2-[3-(methylthio)phenoxy]-N-[4-(1-oxopropylamino)cyclohexyl]-3-pyridinecarboxamide IUPAC Name: 5-fluoro-2-(3-methylsulfanylphenoxy)-N-[4-(propanoylamino)cyclohexyl]pyridine-3-carboxamide Traditional Name: 5-fluoro-2-[3-(methylthio)phenoxy]-N-(4-propionamidocyclohexyl)nicotinamide Formula: C22H26FN3O3S MolecularWeight: 431.523543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1CCC(CC1)NC(=O)C2=CC(=CN=C2OC3=CC(=CC=C3)SC)F

Isomeric SMILES

CCC(=O)NC1CCC(CC1)NC(=O)C2=CC(=CN=C2OC3=CC(=CC=C3)SC)F

InChI

InChI=1S/C22H26FN3O3S/c1-3-20(27)25-15-7-9-16(10-8-15)26-21(28)19-11-14(23)13-24-22(19)29-17-5-4-6-18(12-17)30-2/h4-6,11-13,15-16H,3,7-10H2,1-2H3,(H,25,27)(H,26,28)