O4-ethyl O2-methyl 5-[2-(4-ethylpiperazin-1-yl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 5-[2-(4-ethylpiperazin-1-yl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4-ethyl-1-piperazinyl)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 5-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-ethylpiperazino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)CC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OCC

InChI

InChI=1S/C18H27N3O5S/c1-5-20-7-9-21(10-8-20)11-13(22)19-16-14(17(23)26-6-2)12(3)15(27-16)18(24)25-4/h5-11H2,1-4H3,(H,19,22)