ethyl 4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]-1,2,5-trimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-[4-(2-furoyl)piperazino]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H25N3O6S MolecularWeight: 423.4833

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)C)C)C

InChI

InChI=1S/C19H25N3O6S/c1-5-27-19(24)16-13(2)20(4)14(3)17(16)29(25,26)22-10-8-21(9-11-22)18(23)15-7-6-12-28-15/h6-7,12H,5,8-11H2,1-4H3