5-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonylthiophene-2-carboxylic acid

Systemtic Name: 5-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonylthiophene-2-carboxylic acid Openeye Name: 5-[4-[2-(dimethylamino)-2-oxo-ethyl]piperazine-1-carbonyl]thiophene-2-carboxylic acid CAS Name: 5-[[4-[2-(dimethylamino)-2-oxoethyl]-1-piperazinyl]-oxomethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[4-[2-(dimethylamino)-2-oxoethyl]piperazine-1-carbonyl]thiophene-2-carboxylic acid Traditional Name: 5-[4-[2-(dimethylamino)-2-keto-ethyl]piperazine-1-carbonyl]-2-thenoic acid Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCN(CC1)C(=O)C2=CC=C(S2)C(=O)O

Isomeric SMILES

CN(C)C(=O)CN1CCN(CC1)C(=O)C2=CC=C(S2)C(=O)O

InChI

InChI=1S/C14H19N3O4S/c1-15(2)12(18)9-16-5-7-17(8-6-16)13(19)10-3-4-11(22-10)14(20)21/h3-4H,5-9H2,1-2H3,(H,20,21)