1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C15H21F3N3S+ MolecularWeight: 332.40755

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C15H20F3N3S/c1-2-21-8-4-7-13(21)10-19-14(22)20-12-6-3-5-11(9-12)15(16,17)18/h3,5-6,9,13H,2,4,7-8,10H2,1H3,(H2,19,20,22)/p+1/t13-/m0/s1