[4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 5-aminocarbonyl-1-methyl-pyrrole-3-sulfonate

Systemtic Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 5-aminocarbonyl-1-methyl-pyrrole-3-sulfonate Openeye Name: [4-[methyl(2-thienylsulfonyl)amino]phenyl] 5-carbamoyl-1-methyl-pyrrole-3-sulfonate CAS Name: 5-carbamoyl-1-methyl-3-pyrrolesulfonic acid [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] ester IUPAC Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 5-carbamoyl-1-methylpyrrole-3-sulfonate Traditional Name: 5-carbamoyl-1-methyl-pyrrole-3-sulfonic acid [4-[methyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C17H17N3O6S3 MolecularWeight: 455.52838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H17N3O6S3/c1-19-11-14(10-15(19)17(18)21)29(24,25)26-13-7-5-12(6-8-13)20(2)28(22,23)16-4-3-9-27-16/h3-11H,1-2H3,(H2,18,21)