1-propan-2-yl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-propan-2-yl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-isopropyl-1-(1-isopropylpiperidin-1-ium-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-propan-2-yl-1-(1-propan-2-yl-4-piperidin-1-iumyl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-propan-2-yl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-isopropyl-1-(1-isopropylpiperidin-1-ium-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C19H29F3N3S+ MolecularWeight: 388.51387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)N(C(C)C)C(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)N(C(C)C)C(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H28F3N3S/c1-13(2)24-10-8-17(9-11-24)25(14(3)4)18(26)23-16-7-5-6-15(12-16)19(20,21)22/h5-7,12-14,17H,8-11H2,1-4H3,(H,23,26)/p+1