3-[[2,4,5-tris(hydroxymethyl)phenyl]amino]propanethioamide

Systemtic Name: 3-[[2,4,5-tris(hydroxymethyl)phenyl]amino]propanethioamide Openeye Name: 3-[2,4,5-tris(hydroxymethyl)anilino]propanethioamide CAS Name: 3-[2,4,5-tris(hydroxymethyl)anilino]propanethioamide IUPAC Name: 3-[2,4,5-tris(hydroxymethyl)anilino]propanethioamide Traditional Name: 3-(2,4,5-trimethylolanilino)thiopropionamide Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1CO)NCCC(=S)N)CO)CO

Isomeric SMILES

C1=C(C(=CC(=C1CO)NCCC(=S)N)CO)CO

InChI

InChI=1S/C12H18N2O3S/c13-12(18)1-2-14-11-4-9(6-16)8(5-15)3-10(11)7-17/h3-4,14-17H,1-2,5-7H2,(H2,13,18)