(3-morpholin-4-ylsulfonylphenyl)methyl 4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxylate CAS Name: 4-(diethylsulfamoyl)-1-methyl-2-pyrrolecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-(diethylsulfamoyl)-1-methylpyrrole-2-carboxylate Traditional Name: 4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H29N3O7S2 MolecularWeight: 499.60086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C21H29N3O7S2/c1-4-23(5-2)33(28,29)19-14-20(22(3)15-19)21(25)31-16-17-7-6-8-18(13-17)32(26,27)24-9-11-30-12-10-24/h6-8,13-15H,4-5,9-12,16H2,1-3H3