1-(5-chloranylthiophen-2-yl)-2-(4-ethylpiperazin-1-yl)ethanone; ethanedioic acid

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-2-(4-ethylpiperazin-1-yl)ethanone; ethanedioic acid Openeye Name: 1-(5-chloro-2-thienyl)-2-(4-ethylpiperazin-1-yl)ethanone; oxalic acid CAS Name: 1-(5-chloro-2-thiophenyl)-2-(4-ethyl-1-piperazinyl)ethanone; oxalic acid IUPAC Name: 1-(5-chlorothiophen-2-yl)-2-(4-ethylpiperazin-1-yl)ethanone; oxalic acid Traditional Name: 1-(5-chloro-2-thienyl)-2-(4-ethylpiperazino)ethanone; oxalic acid Formula: C14H19ClN2O5S MolecularWeight: 362.82906

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)C2=CC=C(S2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CC(=O)C2=CC=C(S2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H17ClN2OS.C2H2O4/c1-2-14-5-7-15(8-6-14)9-10(16)11-3-4-12(13)17-11;3-1(4)2(5)6/h3-4H,2,5-9H2,1H3;(H,3,4)(H,5,6)