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

Systemtic Name: 1-pentyl-3-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]carbonylamino]thiourea Openeye Name: 1-pentyl-3-[[1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carbonyl]amino]thiourea CAS Name: 1-[[oxo-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]methyl]amino]-3-pentylthiourea IUPAC Name: 1-pentyl-3-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carbonyl]amino]thiourea Traditional Name: 1-amyl-3-[[1-[5-(trifluoromethyl)-2-pyridyl]isonipecotoyl]amino]thiourea Formula: C18H26F3N5OS MolecularWeight: 417.49215

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26F3N5OS/c1-2-3-4-9-22-17(28)25-24-16(27)13-7-10-26(11-8-13)15-6-5-14(12-23-15)18(19,20)21/h5-6,12-13H,2-4,7-11H2,1H3,(H,24,27)(H2,22,25,28)