5-[3-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[(4-dimethylaminophenyl)methyl-methylsulfonylamino]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[(4-dimethylaminophenyl)methyl-methylsulfonylamino]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[[4-(dimethylamino)benzyl]-mesyl-amino]propyl]-2-thenoic acid Formula: C18H24N2O4S2 MolecularWeight: 396.52416

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(CCCC2=CC=C(S2)C(=O)O)S(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(CCCC2=CC=C(S2)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C18H24N2O4S2/c1-19(2)15-8-6-14(7-9-15)13-20(26(3,23)24)12-4-5-16-10-11-17(25-16)18(21)22/h6-11H,4-5,12-13H2,1-3H3,(H,21,22)