1-phenyl-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-phenyl-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea Openeye Name: 1-phenyl-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea CAS Name: 1-phenyl-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea IUPAC Name: 1-phenyl-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-phenyl-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea Formula: C16H12F3N5O MolecularWeight: 347.29459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=NC=N3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=NC=N3

InChI

InChI=1S/C16H12F3N5O/c17-16(18,19)11-6-7-14(24-10-20-9-21-24)13(8-11)23-15(25)22-12-4-2-1-3-5-12/h1-10H,(H2,22,23,25)