1-(2-ethylsulfanyl-6-phenyl-pyrimidin-4-yl)thiourea

Systemtic Name: 1-(2-ethylsulfanyl-6-phenyl-pyrimidin-4-yl)thiourea Openeye Name: (2-ethylsulfanyl-6-phenyl-pyrimidin-4-yl)thiourea CAS Name: [2-(ethylthio)-6-phenyl-4-pyrimidinyl]thiourea IUPAC Name: (2-ethylsulfanyl-6-phenylpyrimidin-4-yl)thiourea Traditional Name: [2-(ethylthio)-6-phenyl-pyrimidin-4-yl]thiourea Formula: C13H14N4S2 MolecularWeight: 290.40706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=CC(=N1)NC(=S)N)C2=CC=CC=C2

Isomeric SMILES

CCSC1=NC(=CC(=N1)NC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C13H14N4S2/c1-2-19-13-15-10(9-6-4-3-5-7-9)8-11(17-13)16-12(14)18/h3-8H,2H2,1H3,(H3,14,15,16,17,18)