1-(3-cyanopyridin-2-yl)-3-[2-[2,3,5,6-tetrakis(fluoranyl)phenyl]ethyl]thiourea

Systemtic Name: 1-(3-cyanopyridin-2-yl)-3-[2-[2,3,5,6-tetrakis(fluoranyl)phenyl]ethyl]thiourea Openeye Name: 1-(3-cyano-2-pyridyl)-3-[2-(2,3,5,6-tetrafluorophenyl)ethyl]thiourea CAS Name: 1-(3-cyano-2-pyridinyl)-3-[2-(2,3,5,6-tetrafluorophenyl)ethyl]thiourea IUPAC Name: 1-(3-cyanopyridin-2-yl)-3-[2-(2,3,5,6-tetrafluorophenyl)ethyl]thiourea Traditional Name: 1-(3-cyano-2-pyridyl)-3-[2-(2,3,5,6-tetrafluorophenyl)ethyl]thiourea Formula: C15H10F4N4S MolecularWeight: 354.325313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NC(=S)NCCC2=C(C(=CC(=C2F)F)F)F)C#N

Isomeric SMILES

C1=CC(=C(N=C1)NC(=S)NCCC2=C(C(=CC(=C2F)F)F)F)C#N

InChI

InChI=1S/C15H10F4N4S/c16-10-6-11(17)13(19)9(12(10)18)3-5-22-15(24)23-14-8(7-20)2-1-4-21-14/h1-2,4,6H,3,5H2,(H2,21,22,23,24)