1-[2-[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridyl]acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-[3-chloro-2-keto-5-(trifluoromethyl)-1-pyridyl]acetyl]amino]-3-phenyl-thiourea Formula: C15H12ClF3N4O2S MolecularWeight: 404.79459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CN2C=C(C=C(C2=O)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CN2C=C(C=C(C2=O)Cl)C(F)(F)F

InChI

InChI=1S/C15H12ClF3N4O2S/c16-11-6-9(15(17,18)19)7-23(13(11)25)8-12(24)21-22-14(26)20-10-4-2-1-3-5-10/h1-7H,8H2,(H,21,24)(H2,20,22,26)