2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-N-cyclopentyl-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-N-cyclopentyl-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanylmethyl]-N-cyclopentyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(2-chloro-6-fluorophenyl)methylthio]methyl]-N-cyclopentyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanylmethyl]-N-cyclopentyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)thio]methyl]-N-cyclopentyl-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C22H23ClFN3O2S MolecularWeight: 447.953323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H23ClFN3O2S/c23-16-6-3-7-17(24)15(16)11-30-12-20-22(29)27-19-10-13(8-9-18(19)26-20)21(28)25-14-4-1-2-5-14/h3,6-10,14,20,26H,1-2,4-5,11-12H2,(H,25,28)(H,27,29)