3-(4-hydroxyphenyl)-2-(propan-2-ylsulfanylcarbamoylamino)propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-(propan-2-ylsulfanylcarbamoylamino)propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-(isopropylsulfanylcarbamoylamino)propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[oxo-[(propan-2-ylthio)amino]methyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-(propan-2-ylsulfanylcarbamoylamino)propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[(isopropylthio)carbamoylamino]propionic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SNC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

CC(C)SNC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C13H18N2O4S/c1-8(2)20-15-13(19)14-11(12(17)18)7-9-3-5-10(16)6-4-9/h3-6,8,11,16H,7H2,1-2H3,(H,17,18)(H2,14,15,19)