1-(3-chloranyl-4-fluoranyl-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Formula: C14H20ClFN3S+ MolecularWeight: 316.845103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClFN3S/c1-2-19-7-3-4-11(19)9-17-14(20)18-10-5-6-13(16)12(15)8-10/h5-6,8,11H,2-4,7,9H2,1H3,(H2,17,18,20)/p+1/t11-/m1/s1