diethyl 5-[2-[(2-fluorophenyl)methyl-methyl-amino]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-[(2-fluorophenyl)methyl-methyl-amino]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-[(2-fluorophenyl)methyl-methyl-amino]acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[(2-fluorophenyl)methyl-methylamino]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-[(2-fluorophenyl)methyl-methylamino]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-[(2-fluorobenzyl)-methyl-amino]acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H25FN2O5S MolecularWeight: 436.497003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN(C)CC2=CC=CC=C2F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN(C)CC2=CC=CC=C2F

InChI

InChI=1S/C21H25FN2O5S/c1-5-28-20(26)17-13(3)18(21(27)29-6-2)30-19(17)23-16(25)12-24(4)11-14-9-7-8-10-15(14)22/h7-10H,5-6,11-12H2,1-4H3,(H,23,25)