S-(phenylmethyl) N-oxidanyl-N-prop-2-ynyl-carbamothioate

Systemtic Name: S-(phenylmethyl) N-oxidanyl-N-prop-2-ynyl-carbamothioate Openeye Name: S-benzyl N-hydroxy-N-prop-2-ynyl-carbamothioate CAS Name: N-hydroxy-N-prop-2-ynylcarbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-hydroxy-N-prop-2-ynylcarbamothioate Traditional Name: N-hydroxy-N-propargyl-thiocarbamic acid S-benzyl ester Formula: C11H11NO2S MolecularWeight: 221.27554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C(=O)SCC1=CC=CC=C1)O

Isomeric SMILES

C#CCN(C(=O)SCC1=CC=CC=C1)O

InChI

InChI=1S/C11H11NO2S/c1-2-8-12(14)11(13)15-9-10-6-4-3-5-7-10/h1,3-7,14H,8-9H2