2-[(4-fluorophenyl)methylsulfanylmethyl]-N-(3-methylbutyl)-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanylmethyl]-N-(3-methylbutyl)-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(4-fluorophenyl)methylsulfanylmethyl]-N-isopentyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(4-fluorophenyl)methylthio]methyl]-N-(3-methylbutyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(4-fluorophenyl)methylsulfanylmethyl]-N-(3-methylbutyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(4-fluorobenzyl)thio]methyl]-N-isoamyl-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCNC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O2S/c1-14(2)9-10-24-21(27)16-5-8-18-19(11-16)26-22(28)20(25-18)13-29-12-15-3-6-17(23)7-4-15/h3-8,11,14,20,25H,9-10,12-13H2,1-2H3,(H,24,27)(H,26,28)