2-oxidanylethanoic acid; (phenylmethyl) carbamimidothioate

Systemtic Name: 2-oxidanylethanoic acid; (phenylmethyl) carbamimidothioate Openeye Name: 2-benzylisothiourea; 2-hydroxyacetic acid CAS Name: carbamimidothioic acid (phenylmethyl) ester; 2-hydroxyacetic acid IUPAC Name: benzyl carbamimidothioate; 2-hydroxyacetic acid Traditional Name: 2-benzylisothiourea; glycolic acid Formula: C10H14N2O3S MolecularWeight: 242.29476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=N)N.C(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC(=N)N.C(C(=O)O)O

InChI

InChI=1S/C8H10N2S.C2H4O3/c9-8(10)11-6-7-4-2-1-3-5-7;3-1-2(4)5/h1-5H,6H2,(H3,9,10);3H,1H2,(H,4,5)