1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-pyridin-2-ylmethylideneamino]thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-pyridin-2-ylmethylideneamino]thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-2-pyridylmethyleneamino]thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-2-pyridinylmethylideneamino]thiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-pyridin-2-ylmethylideneamino]thiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-2-pyridylmethyleneamino]thiourea Formula: C15H10F6N4S MolecularWeight: 392.322119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10F6N4S/c16-14(17,18)9-5-10(15(19,20)21)7-12(6-9)24-13(26)25-23-8-11-3-1-2-4-22-11/h1-8H,(H2,24,25,26)/b23-8+