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

Systemtic Name: N-butan-2-yl-2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanylmethyl]-3-oxo-N-sec-butyl-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: N-butan-2-yl-2-[[(2-chloro-6-fluorophenyl)methylthio]methyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: N-butan-2-yl-2-[(2-chloro-6-fluorophenyl)methylsulfanylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)thio]methyl]-3-keto-N-sec-butyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C21H23ClFN3O2S MolecularWeight: 435.942623

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCC(C)NC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H23ClFN3O2S/c1-3-12(2)24-20(27)13-7-8-17-18(9-13)26-21(28)19(25-17)11-29-10-14-15(22)5-4-6-16(14)23/h4-9,12,19,25H,3,10-11H2,1-2H3,(H,24,27)(H,26,28)