butyl (2S)-2-ethyl-7-fluoranyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate

Systemtic Name: butyl (2S)-2-ethyl-7-fluoranyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: butyl (2S)-2-ethyl-7-fluoro-3-thioxo-2,4-dihydroquinoxaline-1-carboxylate CAS Name: (2S)-2-ethyl-7-fluoro-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylic acid butyl ester IUPAC Name: butyl (2S)-2-ethyl-7-fluoro-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Traditional Name: (2S)-2-ethyl-7-fluoro-3-thioxo-2,4-dihydroquinoxaline-1-carboxylic acid butyl ester Formula: C15H19FN2O2S MolecularWeight: 310.386963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C(C(=S)NC2=C1C=C(C=C2)F)CC

Isomeric SMILES

CCCCOC(=O)N1[C@H](C(=S)NC2=C1C=C(C=C2)F)CC

InChI

InChI=1S/C15H19FN2O2S/c1-3-5-8-20-15(19)18-12(4-2)14(21)17-11-7-6-10(16)9-13(11)18/h6-7,9,12H,3-5,8H2,1-2H3,(H,17,21)/t12-/m0/s1