1-[[1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]carbonylamino]-3-phenyl-thiourea

Systemtic Name: 1-[[1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]carbonylamino]-3-phenyl-thiourea Openeye Name: 1-[[1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperidine-4-carbonyl]amino]-3-phenyl-thiourea CAS Name: 1-[[[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]-oxomethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carbonyl]amino]-3-phenylthiourea Traditional Name: 1-[[1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]isonipecotoyl]amino]-3-phenyl-thiourea Formula: C19H19ClF3N5OS MolecularWeight: 457.90027

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NNC(=S)NC2=CC=CC=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NNC(=S)NC2=CC=CC=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H19ClF3N5OS/c20-15-10-13(19(21,22)23)11-24-16(15)28-8-6-12(7-9-28)17(29)26-27-18(30)25-14-4-2-1-3-5-14/h1-5,10-12H,6-9H2,(H,26,29)(H2,25,27,30)