1-[2-[5-nitro-3-(trifluoromethyl)pyridin-2-yl]sulfanylphenyl]-3-phenyl-urea

Systemtic Name: 1-[2-[5-nitro-3-(trifluoromethyl)pyridin-2-yl]sulfanylphenyl]-3-phenyl-urea Openeye Name: 1-[2-[[5-nitro-3-(trifluoromethyl)-2-pyridyl]sulfanyl]phenyl]-3-phenyl-urea CAS Name: 1-[2-[[5-nitro-3-(trifluoromethyl)-2-pyridinyl]thio]phenyl]-3-phenylurea IUPAC Name: 1-[2-[5-nitro-3-(trifluoromethyl)pyridin-2-yl]sulfanylphenyl]-3-phenylurea Traditional Name: 1-[2-[[5-nitro-3-(trifluoromethyl)-2-pyridyl]thio]phenyl]-3-phenyl-urea Formula: C19H13F3N4O3S MolecularWeight: 434.39173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2SC3=NC=C(C=C3C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2SC3=NC=C(C=C3C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H13F3N4O3S/c20-19(21,22)14-10-13(26(28)29)11-23-17(14)30-16-9-5-4-8-15(16)25-18(27)24-12-6-2-1-3-7-12/h1-11H,(H2,24,25,27)