5-[[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-ethyl-sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylsulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylsulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-ethyl-sulfamoyl]-3-thenoic acid Formula: C16H17ClN2O5S2 MolecularWeight: 416.89958

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=CS2)C(=O)O

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C16H17ClN2O5S2/c1-2-19(26(23,24)15-7-12(10-25-15)16(21)22)9-14(20)18-8-11-3-5-13(17)6-4-11/h3-7,10H,2,8-9H2,1H3,(H,18,20)(H,21,22)