[1-[2-azanyl-3-(thian-4-yl)propanoyl]pyrrolidin-2-yl]boronic acid

Systemtic Name: [1-[2-azanyl-3-(thian-4-yl)propanoyl]pyrrolidin-2-yl]boronic acid Openeye Name: [1-(2-amino-3-tetrahydrothiopyran-4-yl-propanoyl)pyrrolidin-2-yl]boronic acid CAS Name: [1-[2-amino-1-oxo-3-(4-thianyl)propyl]-2-pyrrolidinyl]boronic acid IUPAC Name: [1-[2-amino-3-(thian-4-yl)propanoyl]pyrrolidin-2-yl]boronic acid Traditional Name: [1-(2-amino-3-tetrahydrothiopyran-4-yl-propanoyl)pyrrolidin-2-yl]boronic acid Formula: C12H23BN2O3S MolecularWeight: 286.19862

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Descriptors Computed from Structure

Canonical SMILES:

B(C1CCCN1C(=O)C(CC2CCSCC2)N)(O)O

Isomeric SMILES

B(C1CCCN1C(=O)C(CC2CCSCC2)N)(O)O

InChI

InChI=1S/C12H23BN2O3S/c14-10(8-9-3-6-19-7-4-9)12(16)15-5-1-2-11(15)13(17)18/h9-11,17-18H,1-8,14H2