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

Systemtic Name: 1-tert-butyl-3-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[[1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carbonyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[oxo-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]methyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carbonyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[1-[5-(trifluoromethyl)-2-pyridyl]isonipecotoyl]amino]thiourea Formula: C17H24F3N5OS MolecularWeight: 403.46557

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H24F3N5OS/c1-16(2,3)22-15(27)24-23-14(26)11-6-8-25(9-7-11)13-5-4-12(10-21-13)17(18,19)20/h4-5,10-11H,6-9H2,1-3H3,(H,23,26)(H2,22,24,27)