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

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanylmethyl]-3-oxidanylidene-N-(1-phenylethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(3-fluorophenyl)methylsulfanylmethyl]-3-oxo-N-(1-phenylethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(3-fluorophenyl)methylthio]methyl]-3-oxo-N-(1-phenylethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(3-fluorophenyl)methylsulfanylmethyl]-3-oxo-N-(1-phenylethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(3-fluorobenzyl)thio]methyl]-3-keto-N-(1-phenylethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C25H24FN3O2S MolecularWeight: 449.540363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=CC(=CC=C4)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=CC(=CC=C4)F

InChI

InChI=1S/C25H24FN3O2S/c1-16(18-7-3-2-4-8-18)27-24(30)19-10-11-21-22(13-19)29-25(31)23(28-21)15-32-14-17-6-5-9-20(26)12-17/h2-13,16,23,28H,14-15H2,1H3,(H,27,30)(H,29,31)