5-[1-[3-(3-chlorophenyl)propyl-ethylsulfonyl-amino]propyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[1-[3-(3-chlorophenyl)propyl-ethylsulfonyl-amino]propyl]thiophene-3-carboxylic acid Openeye Name: 5-[1-[3-(3-chlorophenyl)propyl-ethylsulfonyl-amino]propyl]thiophene-3-carboxylic acid CAS Name: 5-[1-[3-(3-chlorophenyl)propyl-ethylsulfonylamino]propyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[1-[3-(3-chlorophenyl)propyl-ethylsulfonylamino]propyl]thiophene-3-carboxylic acid Traditional Name: 5-[1-[3-(3-chlorophenyl)propyl-esyl-amino]propyl]-3-thenoic acid Formula: C19H24ClNO4S2 MolecularWeight: 429.98116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CS1)C(=O)O)N(CCCC2=CC(=CC=C2)Cl)S(=O)(=O)CC

Isomeric SMILES

CCC(C1=CC(=CS1)C(=O)O)N(CCCC2=CC(=CC=C2)Cl)S(=O)(=O)CC

InChI

InChI=1S/C19H24ClNO4S2/c1-3-17(18-12-15(13-26-18)19(22)23)21(27(24,25)4-2)10-6-8-14-7-5-9-16(20)11-14/h5,7,9,11-13,17H,3-4,6,8,10H2,1-2H3,(H,22,23)