3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H19FN2O4S/c1-27-12-13-18-14(22)6-4-9-17(18)29-19(13)20(25)28-11-5-10-24-16-8-3-2-7-15(16)23-21(24)26/h2-4,6-9H,5,10-12H2,1H3,(H,23,26)