ethyl 3-[[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[[[2-(tert-butylamino)-2-oxo-ethyl]-methyl-amino]methyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[[2-(tert-butylamino)-2-oxoethyl]-methylamino]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[[2-(tert-butylamino)-2-oxoethyl]-methylamino]methyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[[[2-(tert-butylamino)-2-keto-ethyl]-methyl-amino]methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C19H25FN2O3S MolecularWeight: 380.476803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN(C)CC(=O)NC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN(C)CC(=O)NC(C)(C)C

InChI

InChI=1S/C19H25FN2O3S/c1-6-25-18(24)17-12(16-13(20)8-7-9-14(16)26-17)10-22(5)11-15(23)21-19(2,3)4/h7-9H,6,10-11H2,1-5H3,(H,21,23)