5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-1-methyl-N-propan-2-yl-pyrrole-3-sulfonamide

Systemtic Name: 5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-1-methyl-N-propan-2-yl-pyrrole-3-sulfonamide Openeye Name: 5-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazine-1-carbonyl]-N-isopropyl-1-methyl-pyrrole-3-sulfonamide CAS Name: 5-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-oxomethyl]-1-methyl-N-propan-2-yl-3-pyrrolesulfonamide IUPAC Name: 5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1-carbonyl]-1-methyl-N-propan-2-ylpyrrole-3-sulfonamide Traditional Name: 5-[4-(coumaran-5-ylmethyl)piperazine-1-carbonyl]-N-isopropyl-1-methyl-pyrrole-3-sulfonamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CN(C(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)C

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CN(C(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)C

InChI

InChI=1S/C22H30N4O4S/c1-16(2)23-31(28,29)19-13-20(24(3)15-19)22(27)26-9-7-25(8-10-26)14-17-4-5-21-18(12-17)6-11-30-21/h4-5,12-13,15-16,23H,6-11,14H2,1-3H3