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

Systemtic Name: ethyl 4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[4-(2-furoyl)piperazino]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O6S/c1-4-26-18(23)15-12(2)19-13(3)16(15)28(24,25)21-9-7-20(8-10-21)17(22)14-6-5-11-27-14/h5-6,11,19H,4,7-10H2,1-3H3