1-[(E)-[2,6-bis(fluoranyl)phenyl]methylideneamino]-3-pyridin-3-yl-thiourea

Systemtic Name: 1-[(E)-[2,6-bis(fluoranyl)phenyl]methylideneamino]-3-pyridin-3-yl-thiourea Openeye Name: 1-[(E)-(2,6-difluorophenyl)methyleneamino]-3-(3-pyridyl)thiourea CAS Name: 1-[(E)-(2,6-difluorophenyl)methylideneamino]-3-(3-pyridinyl)thiourea IUPAC Name: 1-[(E)-(2,6-difluorophenyl)methylideneamino]-3-pyridin-3-ylthiourea Traditional Name: 1-[(E)-(2,6-difluorobenzylidene)amino]-3-(3-pyridyl)thiourea Formula: C13H10F2N4S MolecularWeight: 292.307106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=C(C(=C1)F)/C=N/NC(=S)NC2=CN=CC=C2)F

InChI

InChI=1S/C13H10F2N4S/c14-11-4-1-5-12(15)10(11)8-17-19-13(20)18-9-3-2-6-16-7-9/h1-8H,(H2,18,19,20)/b17-8+