5-[[4-(morpholin-4-ylmethyl)phenyl]-(thiophen-2-ylmethyl)sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[4-(morpholin-4-ylmethyl)phenyl]-(thiophen-2-ylmethyl)sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[4-(morpholinomethyl)phenyl]-(2-thienylmethyl)sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[4-(4-morpholinylmethyl)phenyl]-(thiophen-2-ylmethyl)sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[4-(morpholin-4-ylmethyl)phenyl]-(thiophen-2-ylmethyl)sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[4-(morpholinomethyl)phenyl]-(2-thenyl)sulfamoyl]-3-thenoic acid Formula: C21H22N2O5S3 MolecularWeight: 478.60478

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=C(C=C2)N(CC3=CC=CS3)S(=O)(=O)C4=CC(=CS4)C(=O)O

Isomeric SMILES

C1COCCN1CC2=CC=C(C=C2)N(CC3=CC=CS3)S(=O)(=O)C4=CC(=CS4)C(=O)O

InChI

InChI=1S/C21H22N2O5S3/c24-21(25)17-12-20(30-15-17)31(26,27)23(14-19-2-1-11-29-19)18-5-3-16(4-6-18)13-22-7-9-28-10-8-22/h1-6,11-12,15H,7-10,13-14H2,(H,24,25)