N-(1-ethanoylpiperidin-4-yl)-2-(4-ethylsulfanylphenoxy)-5-fluoranyl-pyridine-3-carboxamide

Systemtic Name: N-(1-ethanoylpiperidin-4-yl)-2-(4-ethylsulfanylphenoxy)-5-fluoranyl-pyridine-3-carboxamide Openeye Name: N-(1-acetyl-4-piperidyl)-2-(4-ethylsulfanylphenoxy)-5-fluoro-pyridine-3-carboxamide CAS Name: N-(1-acetyl-4-piperidinyl)-2-[4-(ethylthio)phenoxy]-5-fluoro-3-pyridinecarboxamide IUPAC Name: N-(1-acetylpiperidin-4-yl)-2-(4-ethylsulfanylphenoxy)-5-fluoropyridine-3-carboxamide Traditional Name: N-(1-acetyl-4-piperidyl)-2-[4-(ethylthio)phenoxy]-5-fluoro-nicotinamide Formula: C21H24FN3O3S MolecularWeight: 417.496963

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)OC2=NC=C(C=C2C(=O)NC3CCN(CC3)C(=O)C)F

Isomeric SMILES

CCSC1=CC=C(C=C1)OC2=NC=C(C=C2C(=O)NC3CCN(CC3)C(=O)C)F

InChI

InChI=1S/C21H24FN3O3S/c1-3-29-18-6-4-17(5-7-18)28-21-19(12-15(22)13-23-21)20(27)24-16-8-10-25(11-9-16)14(2)26/h4-7,12-13,16H,3,8-11H2,1-2H3,(H,24,27)