1-azanyl-1-(4-methyl-2-sulfanyl-phenyl)propane-1,3-diol

Systemtic Name: 1-azanyl-1-(4-methyl-2-sulfanyl-phenyl)propane-1,3-diol Openeye Name: 1-amino-1-(4-methyl-2-sulfanyl-phenyl)propane-1,3-diol CAS Name: 1-amino-1-(2-mercapto-4-methylphenyl)propane-1,3-diol IUPAC Name: 1-amino-1-(4-methyl-2-sulfanylphenyl)propane-1,3-diol Traditional Name: 1-amino-1-(2-mercapto-4-methyl-phenyl)propane-1,3-diol Formula: C10H15NO2S MolecularWeight: 213.2966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(CCO)(N)O)S

Isomeric SMILES

CC1=CC(=C(C=C1)C(CCO)(N)O)S

InChI

InChI=1S/C10H15NO2S/c1-7-2-3-8(9(14)6-7)10(11,13)4-5-12/h2-3,6,12-14H,4-5,11H2,1H3