4-[2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC=CN3C4=CC(=CC=C4)F)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC=CN3C4=CC(=CC=C4)F)C

InChI

InChI=1S/C21H19FN4O2S/c1-21(2)19(28)24-16-8-3-4-9-17(16)26(21)18(27)13-29-20-23-10-11-25(20)15-7-5-6-14(22)12-15/h3-12H,13H2,1-2H3,(H,24,28)