5-[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[4-(3-methylpiperidino)sulfonylphenyl]sulfamoyl]-3-thenoic acid Formula: C17H20N2O6S3 MolecularWeight: 444.5455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C17H20N2O6S3/c1-12-3-2-8-19(10-12)28(24,25)15-6-4-14(5-7-15)18-27(22,23)16-9-13(11-26-16)17(20)21/h4-7,9,11-12,18H,2-3,8,10H2,1H3,(H,20,21)