ethanedioic acid; 2-(4-ethylpiperazin-1-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: ethanedioic acid; 2-(4-ethylpiperazin-1-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-ethylpiperazin-1-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide; oxalic acid CAS Name: 2-(4-ethyl-1-piperazinyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide; oxalic acid IUPAC Name: 2-(4-ethylpiperazin-1-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide; oxalic acid Traditional Name: 2-(4-ethylpiperazino)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide; oxalic acid Formula: C18H24N4O6S MolecularWeight: 424.47136

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H22N4O2S.C2H2O4/c1-3-19-6-8-20(9-7-19)11-15(21)18-16-17-13-5-4-12(22-2)10-14(13)23-16;3-1(4)2(5)6/h4-5,10H,3,6-9,11H2,1-2H3,(H,17,18,21);(H,3,4)(H,5,6)