2-[2-[[5-chloranyl-4-(2-methylsulfonyloxyethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid

Systemtic Name: 2-[2-[[5-chloranyl-4-(2-methylsulfonyloxyethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid Openeye Name: 2-[2-[[5-chloro-4-(2-methylsulfonyloxyethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid CAS Name: 2-[2-[[5-chloro-4-(2-methylsulfonyloxyethyl)-2-pyrimidinyl]amino]ethyl]-1-piperidinecarboxylic acid IUPAC Name: 2-[2-[[5-chloro-4-(2-methylsulfonyloxyethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid Traditional Name: 2-[2-[[5-chloro-4-(2-methylsulfonyloxyethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid Formula: C15H23ClN4O5S MolecularWeight: 406.88492

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1=NC(=NC=C1Cl)NCCC2CCCCN2C(=O)O

Isomeric SMILES

CS(=O)(=O)OCCC1=NC(=NC=C1Cl)NCCC2CCCCN2C(=O)O

InChI

InChI=1S/C15H23ClN4O5S/c1-26(23,24)25-9-6-13-12(16)10-18-14(19-13)17-7-5-11-4-2-3-8-20(11)15(21)22/h10-11H,2-9H2,1H3,(H,21,22)(H,17,18,19)