2-[(6-fluoranyl-5-morpholin-4-yl-1H-benzimidazol-2-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(6-fluoranyl-5-morpholin-4-yl-1H-benzimidazol-2-yl)sulfanyl]ethanoate Openeye Name: 2-[(6-fluoro-5-morpholino-1H-benzimidazol-2-yl)sulfanyl]acetate CAS Name: 2-[[6-fluoro-5-(4-morpholinyl)-1H-benzimidazol-2-yl]thio]acetate IUPAC Name: 2-[(6-fluoro-5-morpholin-4-yl-1H-benzimidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-fluoro-5-morpholino-1H-benzimidazol-2-yl)thio]acetate Formula: C13H13FN3O3S- MolecularWeight: 310.324023

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C3C(=C2)N=C(N3)SCC(=O)[O-])F

Isomeric SMILES

C1COCCN1C2=C(C=C3C(=C2)N=C(N3)SCC(=O)[O-])F

InChI

InChI=1S/C13H14FN3O3S/c14-8-5-9-10(16-13(15-9)21-7-12(18)19)6-11(8)17-1-3-20-4-2-17/h5-6H,1-4,7H2,(H,15,16)(H,18,19)/p-1