2-[4-(4-thiomorpholin-4-ylcarbonylcyclohexyl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4-thiomorpholin-4-ylcarbonylcyclohexyl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[4-(thiomorpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[oxo-[4-[oxo(thiomorpholin-4-yl)methyl]cyclohexyl]methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[4-(thiomorpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[4-(thiomorpholine-4-carbonyl)cyclohexanecarbonyl]piperazino]acetic acid Formula: C18H29N3O4S MolecularWeight: 383.50556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)N2CCN(CC2)CC(=O)O)C(=O)N3CCSCC3

Isomeric SMILES

C1CC(CCC1C(=O)N2CCN(CC2)CC(=O)O)C(=O)N3CCSCC3

InChI

InChI=1S/C18H29N3O4S/c22-16(23)13-19-5-7-20(8-6-19)17(24)14-1-3-15(4-2-14)18(25)21-9-11-26-12-10-21/h14-15H,1-13H2,(H,22,23)