1-[3,5-bis(fluoranyl)phenyl]-3-(pyridin-3-ylcarbonylamino)thiourea

Systemtic Name: 1-[3,5-bis(fluoranyl)phenyl]-3-(pyridin-3-ylcarbonylamino)thiourea Openeye Name: 1-(3,5-difluorophenyl)-3-(pyridine-3-carbonylamino)thiourea CAS Name: 1-(3,5-difluorophenyl)-3-[[oxo(3-pyridinyl)methyl]amino]thiourea IUPAC Name: 1-(3,5-difluorophenyl)-3-(pyridine-3-carbonylamino)thiourea Traditional Name: 1-(3,5-difluorophenyl)-3-nicotinamido-thiourea Formula: C13H10F2N4OS MolecularWeight: 308.306506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NNC(=S)NC2=CC(=CC(=C2)F)F

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NNC(=S)NC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C13H10F2N4OS/c14-9-4-10(15)6-11(5-9)17-13(21)19-18-12(20)8-2-1-3-16-7-8/h1-7H,(H,18,20)(H2,17,19,21)