4-cyclopropyl-5-pyridin-4-yl-2-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[(3S)-3-(trifluoromethyl)-1-piperidyl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[(3S)-3-(trifluoromethyl)-1-piperidinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[(3S)-3-(trifluoromethyl)piperidino]methyl]-1,2,4-triazole-3-thione Formula: C17H20F3N5S MolecularWeight: 383.43441

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4)C(F)(F)F

Isomeric SMILES

C1C[C@@H](CN(C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4)C(F)(F)F

InChI

InChI=1S/C17H20F3N5S/c18-17(19,20)13-2-1-9-23(10-13)11-24-16(26)25(14-3-4-14)15(22-24)12-5-7-21-8-6-12/h5-8,13-14H,1-4,9-11H2/t13-/m0/s1