[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C15H16FNO3S MolecularWeight: 309.355843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC2=C(C=CC=C2S1)F

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=CC2=C(C=CC=C2S1)F

InChI

InChI=1S/C15H16FNO3S/c1-3-9(2)17-14(18)8-20-15(19)13-7-10-11(16)5-4-6-12(10)21-13/h4-7,9H,3,8H2,1-2H3,(H,17,18)