5-(4-propan-2-ylpiperazin-1-yl)sulfonylthiophene-3-carboxylic acid

Systemtic Name: 5-(4-propan-2-ylpiperazin-1-yl)sulfonylthiophene-3-carboxylic acid Openeye Name: 5-(4-isopropylpiperazin-1-yl)sulfonylthiophene-3-carboxylic acid CAS Name: 5-[(4-propan-2-yl-1-piperazinyl)sulfonyl]-3-thiophenecarboxylic acid IUPAC Name: 5-(4-propan-2-ylpiperazin-1-yl)sulfonylthiophene-3-carboxylic acid Traditional Name: 5-(4-isopropylpiperazino)sulfonyl-3-thenoic acid Formula: C12H18N2O4S2 MolecularWeight: 318.41232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC(=CS2)C(=O)O

Isomeric SMILES

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C12H18N2O4S2/c1-9(2)13-3-5-14(6-4-13)20(17,18)11-7-10(8-19-11)12(15)16/h7-9H,3-6H2,1-2H3,(H,15,16)