5-phenylazanyl-3-[[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-phenylazanyl-3-[[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-anilino-3-[[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-anilino-3-[[(3R)-3-(trifluoromethyl)-1-piperidin-1-iumyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-anilino-3-[[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-anilino-3-[[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Formula: C15H18F3N4S2+ MolecularWeight: 375.45543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CN2C(=S)SC(=N2)NC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

C1C[C@H](C[NH+](C1)CN2C(=S)SC(=N2)NC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C15H17F3N4S2/c16-15(17,18)11-5-4-8-21(9-11)10-22-14(23)24-13(20-22)19-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,19,20)/p+1/t11-/m1/s1