[2-[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]-2-oxidanylidene-ethyl] 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]-2-oxidanylidene-ethyl] 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxo-ethyl] 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid [2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethyl] 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid [2-keto-2-[[2-keto-2-(propylamino)ethyl]-methyl-amino]ethyl] ester Formula: C17H19FN2O4S MolecularWeight: 366.407163

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C(=O)COC(=O)C1=CC2=C(S1)C=CC(=C2)F

Isomeric SMILES

CCCNC(=O)CN(C)C(=O)COC(=O)C1=CC2=C(S1)C=CC(=C2)F

InChI

InChI=1S/C17H19FN2O4S/c1-3-6-19-15(21)9-20(2)16(22)10-24-17(23)14-8-11-7-12(18)4-5-13(11)25-14/h4-5,7-8H,3,6,9-10H2,1-2H3,(H,19,21)