1-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]-3-(4-phenoxyphenyl)thiourea Formula: C19H14ClF3N4OS MolecularWeight: 438.85387

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NNC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NNC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H14ClF3N4OS/c20-16-10-12(19(21,22)23)11-24-17(16)26-27-18(29)25-13-6-8-15(9-7-13)28-14-4-2-1-3-5-14/h1-11H,(H,24,26)(H2,25,27,29)