1-(2-chlorophenyl)-3-[5-(hydroxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]urea

Systemtic Name: 1-(2-chlorophenyl)-3-[5-(hydroxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]urea Openeye Name: 1-(2-chlorophenyl)-3-[5-(hydroxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]urea CAS Name: 1-(2-chlorophenyl)-3-[5-(hydroxymethyl)-2-(methylthio)-4-pyrimidinyl]urea IUPAC Name: 1-(2-chlorophenyl)-3-[5-(hydroxymethyl)-2-methylsulfanylpyrimidin-4-yl]urea Traditional Name: 1-(2-chlorophenyl)-3-[5-methylol-2-(methylthio)pyrimidin-4-yl]urea Formula: C13H13ClN4O2S MolecularWeight: 324.78592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC(=O)NC2=CC=CC=C2Cl)CO

Isomeric SMILES

CSC1=NC=C(C(=N1)NC(=O)NC2=CC=CC=C2Cl)CO

InChI

InChI=1S/C13H13ClN4O2S/c1-21-13-15-6-8(7-19)11(18-13)17-12(20)16-10-5-3-2-4-9(10)14/h2-6,19H,7H2,1H3,(H2,15,16,17,18,20)