dimethyl 5-[3-[4-(4-ethanoylphenyl)piperazin-1-yl]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[3-[4-(4-ethanoylphenyl)piperazin-1-yl]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[3-[4-(4-acetylphenyl)piperazin-1-yl]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[3-[4-(4-acetylphenyl)-1-piperazinyl]-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[4-(4-acetylphenyl)piperazin-1-yl]propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-[4-(4-acetylphenyl)piperazino]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN2CCN(CC2)C3=CC=C(C=C3)C(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN2CCN(CC2)C3=CC=C(C=C3)C(=O)C)C(=O)OC

InChI

InChI=1S/C24H29N3O6S/c1-15-20(23(30)32-3)22(34-21(15)24(31)33-4)25-19(29)9-10-26-11-13-27(14-12-26)18-7-5-17(6-8-18)16(2)28/h5-8H,9-14H2,1-4H3,(H,25,29)