5-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[2-methyl-5-(1-piperidylsulfonyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[(2-methyl-5-piperidin-1-ylsulfonylphenyl)sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[(2-methyl-5-piperidinosulfonyl-phenyl)sulfamoyl]-3-thenoic acid Formula: C17H20N2O6S3 MolecularWeight: 444.5455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C17H20N2O6S3/c1-12-5-6-14(28(24,25)19-7-3-2-4-8-19)10-15(12)18-27(22,23)16-9-13(11-26-16)17(20)21/h5-6,9-11,18H,2-4,7-8H2,1H3,(H,20,21)