3-[(5-azanyl-2-oxidanyl-phenyl)methylsulfanyl]propane-1,2-diol

Systemtic Name: 3-[(5-azanyl-2-oxidanyl-phenyl)methylsulfanyl]propane-1,2-diol Openeye Name: 3-[(5-amino-2-hydroxy-phenyl)methylsulfanyl]propane-1,2-diol CAS Name: 3-[(5-amino-2-hydroxyphenyl)methylthio]propane-1,2-diol IUPAC Name: 3-[(5-amino-2-hydroxyphenyl)methylsulfanyl]propane-1,2-diol Traditional Name: 3-[(5-amino-2-hydroxy-benzyl)thio]propane-1,2-diol Formula: C10H15NO3S MolecularWeight: 229.296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)CSCC(CO)O)O

Isomeric SMILES

C1=CC(=C(C=C1N)CSCC(CO)O)O

InChI

InChI=1S/C10H15NO3S/c11-8-1-2-10(14)7(3-8)5-15-6-9(13)4-12/h1-3,9,12-14H,4-6,11H2