5-[3-[4-(3-chlorophenyl)butylsulfonylamino]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[4-(3-chlorophenyl)butylsulfonylamino]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[4-(3-chlorophenyl)butylsulfonylamino]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[4-(3-chlorophenyl)butylsulfonylamino]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[4-(3-chlorophenyl)butylsulfonylamino]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[4-(3-chlorophenyl)butylsulfonylamino]propyl]-2-thenoic acid Formula: C18H22ClNO4S2 MolecularWeight: 415.95458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCCCS(=O)(=O)NCCCC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCCCS(=O)(=O)NCCCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C18H22ClNO4S2/c19-15-7-3-6-14(13-15)5-1-2-12-26(23,24)20-11-4-8-16-9-10-17(25-16)18(21)22/h3,6-7,9-10,13,20H,1-2,4-5,8,11-12H2,(H,21,22)