1-(5-methyl-1,2-oxazol-3-yl)-3-(3-pyrimidin-2-ylsulfanylpropyl)urea

Systemtic Name: 1-(5-methyl-1,2-oxazol-3-yl)-3-(3-pyrimidin-2-ylsulfanylpropyl)urea Openeye Name: 1-(5-methylisoxazol-3-yl)-3-(3-pyrimidin-2-ylsulfanylpropyl)urea CAS Name: 1-(5-methyl-3-isoxazolyl)-3-[3-(2-pyrimidinylthio)propyl]urea IUPAC Name: 1-(5-methyl-1,2-oxazol-3-yl)-3-(3-pyrimidin-2-ylsulfanylpropyl)urea Traditional Name: 1-(5-methylisoxazol-3-yl)-3-[3-(2-pyrimidylthio)propyl]urea Formula: C12H15N5O2S MolecularWeight: 293.3448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)NCCCSC2=NC=CC=N2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)NCCCSC2=NC=CC=N2

InChI

InChI=1S/C12H15N5O2S/c1-9-8-10(17-19-9)16-11(18)13-6-3-7-20-12-14-4-2-5-15-12/h2,4-5,8H,3,6-7H2,1H3,(H2,13,16,17,18)