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

Systemtic Name: ethyl 3-[[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[[[2-(cyclopropylamino)-2-oxo-ethyl]-methyl-amino]methyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]methyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[[[2-(cyclopropylamino)-2-keto-ethyl]-methyl-amino]methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C18H21FN2O3S MolecularWeight: 364.434343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN(C)CC(=O)NC3CC3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN(C)CC(=O)NC3CC3

InChI

InChI=1S/C18H21FN2O3S/c1-3-24-18(23)17-12(16-13(19)5-4-6-14(16)25-17)9-21(2)10-15(22)20-11-7-8-11/h4-6,11H,3,7-10H2,1-2H3,(H,20,22)