[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C16H18FNO3S MolecularWeight: 323.382423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=CC2=C(C=CC=C2S1)F

InChI

InChI=1S/C16H18FNO3S/c1-3-5-10(2)18-15(19)9-21-16(20)14-8-11-12(17)6-4-7-13(11)22-14/h4,6-8,10H,3,5,9H2,1-2H3,(H,18,19)/t10-/m0/s1