3-(4-fluorophenyl)-2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-imidazole-4-carboxylate

Systemtic Name: 3-(4-fluorophenyl)-2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-imidazole-4-carboxylate Openeye Name: 3-(4-fluorophenyl)-2-[2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl]sulfanyl-imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-2-[[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]thio]-4-imidazolecarboxylate IUPAC Name: 3-(4-fluorophenyl)-2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]sulfanylimidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)-2-[[2-keto-2-[(2S)-2-methylindolin-1-yl]ethyl]thio]imidazole-4-carboxylate Formula: C21H17FN3O3S- MolecularWeight: 410.441383

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC=C(N3C4=CC=C(C=C4)F)C(=O)[O-]

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)CSC3=NC=C(N3C4=CC=C(C=C4)F)C(=O)[O-]

InChI

InChI=1S/C21H18FN3O3S/c1-13-10-14-4-2-3-5-17(14)24(13)19(26)12-29-21-23-11-18(20(27)28)25(21)16-8-6-15(22)7-9-16/h2-9,11,13H,10,12H2,1H3,(H,27,28)/p-1/t13-/m0/s1