diethyl 3-methyl-5-[2-(4-phenylpiperazin-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(4-phenylpiperazin-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(4-phenyl-1-piperazinyl)ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(4-phenylpiperazino)acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O5S/c1-4-30-22(28)19-16(3)20(23(29)31-5-2)32-21(19)24-18(27)15-25-11-13-26(14-12-25)17-9-7-6-8-10-17/h6-10H,4-5,11-15H2,1-3H3,(H,24,27)