2-[2-[(4-chloranyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-propyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-[(4-chloranyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-propyl-pyridine-3-carboxamide Openeye Name: 2-[2-(4-chloro-2-fluoro-anilino)-2-oxo-ethyl]sulfanyl-N-propyl-pyridine-3-carboxamide CAS Name: 2-[[2-(4-chloro-2-fluoroanilino)-2-oxoethyl]thio]-N-propyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(4-chloro-2-fluoroanilino)-2-oxoethyl]sulfanyl-N-propylpyridine-3-carboxamide Traditional Name: 2-[[2-(4-chloro-2-fluoro-anilino)-2-keto-ethyl]thio]-N-propyl-nicotinamide Formula: C17H17ClFN3O2S MolecularWeight: 381.852183

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(N=CC=C1)SCC(=O)NC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CCCNC(=O)C1=C(N=CC=C1)SCC(=O)NC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C17H17ClFN3O2S/c1-2-7-20-16(24)12-4-3-8-21-17(12)25-10-15(23)22-14-6-5-11(18)9-13(14)19/h3-6,8-9H,2,7,10H2,1H3,(H,20,24)(H,22,23)