4-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-(1-amino-4-phenyl-imidazol-2-yl)sulfanylacetyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[(1-amino-4-phenyl-2-imidazolyl)thio]-1-oxoethyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-(1-amino-4-phenylimidazol-2-yl)sulfanylacetyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(1-amino-4-phenyl-imidazol-2-yl)thio]acetyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one Formula: C20H16F3N5O2S MolecularWeight: 447.43355

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(N1C(=O)CSC3=NC(=CN3N)C4=CC=CC=C4)C=CC(=C2)C(F)(F)F

Isomeric SMILES

C1C(=O)NC2=C(N1C(=O)CSC3=NC(=CN3N)C4=CC=CC=C4)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H16F3N5O2S/c21-20(22,23)13-6-7-16-14(8-13)25-17(29)10-27(16)18(30)11-31-19-26-15(9-28(19)24)12-4-2-1-3-5-12/h1-9H,10-11,24H2,(H,25,29)