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

Systemtic Name: butan-2-yl (2S)-2-ethyl-7-fluoranyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: sec-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 butan-2-yl ester IUPAC Name: butan-2-yl (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 sec-butyl ester Formula: C15H19FN2O2S MolecularWeight: 310.386963

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=S)NC2=C(N1C(=O)OC(C)CC)C=C(C=C2)F

Isomeric SMILES

CC[C@H]1C(=S)NC2=C(N1C(=O)OC(C)CC)C=C(C=C2)F

InChI

InChI=1S/C15H19FN2O2S/c1-4-9(3)20-15(19)18-12(5-2)14(21)17-11-7-6-10(16)8-13(11)18/h6-9,12H,4-5H2,1-3H3,(H,17,21)/t9?,12-/m0/s1