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

Systemtic Name: diethyl 3-methyl-5-[2-[4-(4-nitrophenyl)piperazin-1-yl]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-[4-(4-nitrophenyl)piperazin-1-yl]acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-[4-(4-nitrophenyl)piperazin-1-yl]acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[4-(4-nitrophenyl)piperazino]acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H28N4O7S MolecularWeight: 504.55602

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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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O7S/c1-4-33-22(29)19-15(3)20(23(30)34-5-2)35-21(19)24-18(28)14-25-10-12-26(13-11-25)16-6-8-17(9-7-16)27(31)32/h6-9H,4-5,10-14H2,1-3H3,(H,24,28)