ethanedioic acid; [4-(4-methylpiperazin-1-yl)piperidin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: ethanedioic acid; [4-(4-methylpiperazin-1-yl)piperidin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(4-methylpiperazin-1-yl)-1-piperidyl]-(2-thienyl)methanone; oxalic acid CAS Name: [4-(4-methyl-1-piperazinyl)-1-piperidinyl]-thiophen-2-ylmethanone; oxalic acid IUPAC Name: [4-(4-methylpiperazin-1-yl)piperidin-1-yl]-thiophen-2-ylmethanone; oxalic acid Traditional Name: [4-(4-methylpiperazino)piperidino]-(2-thienyl)methanone; oxalic acid Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2)C(=O)C3=CC=CS3.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2)C(=O)C3=CC=CS3.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23N3OS.C2H2O4/c1-16-8-10-17(11-9-16)13-4-6-18(7-5-13)15(19)14-3-2-12-20-14;3-1(4)2(5)6/h2-3,12-13H,4-11H2,1H3;(H,3,4)(H,5,6)