(1-oxidanyl-1-oxidanylidene-3-quinolin-2-ylsulfanyl-propan-2-yl)carbamoylboron

Systemtic Name: (1-oxidanyl-1-oxidanylidene-3-quinolin-2-ylsulfanyl-propan-2-yl)carbamoylboron Openeye Name: [2-hydroxy-2-oxo-1-(2-quinolylsulfanylmethyl)ethyl]carbamoylboron CAS Name: [[[1-hydroxy-1-oxo-3-(2-quinolinylthio)propan-2-yl]amino]-oxomethyl]boron IUPAC Name: (1-hydroxy-1-oxo-3-quinolin-2-ylsulfanylpropan-2-yl)carbamoylboron Traditional Name: [2-hydroxy-2-keto-1-[(2-quinolylthio)methyl]ethyl]carbamoylboron Formula: C13H11BN2O3S MolecularWeight: 286.11404

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NC(CSC1=NC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

[B]C(=O)NC(CSC1=NC2=CC=CC=C2C=C1)C(=O)O

InChI

InChI=1S/C13H11BN2O3S/c14-13(19)16-10(12(17)18)7-20-11-6-5-8-3-1-2-4-9(8)15-11/h1-6,10H,7H2,(H,16,19)(H,17,18)