ethyl 5-[2-[2-(2-fluoranylphenoxy)ethyl-methyl-amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[2-(2-fluoranylphenoxy)ethyl-methyl-amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[2-(2-fluorophenoxy)ethyl-methyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[2-(2-fluorophenoxy)ethyl-methylamino]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[2-(2-fluorophenoxy)ethyl-methylamino]acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[2-(2-fluorophenoxy)ethyl-methyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H23FN2O4S MolecularWeight: 394.460323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN(C)CCOC2=CC=CC=C2F)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN(C)CCOC2=CC=CC=C2F)C

InChI

InChI=1S/C19H23FN2O4S/c1-4-25-19(24)18-13(2)11-17(27-18)21-16(23)12-22(3)9-10-26-15-8-6-5-7-14(15)20/h5-8,11H,4,9-10,12H2,1-3H3,(H,21,23)