4-[4-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-(2,3-dihydrobenzofuran-5-carbonyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[2,3-dihydrobenzofuran-5-yl(oxo)methyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-(2,3-dihydro-1-benzofuran-5-carbonyl)piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-(coumaran-5-carbonyl)piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C19H22N4O5S/c1-21-12-15(11-16(21)18(20)24)29(26,27)23-7-5-22(6-8-23)19(25)14-2-3-17-13(10-14)4-9-28-17/h2-3,10-12H,4-9H2,1H3,(H2,20,24)