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

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Formula: C15H23ClN3S+ MolecularWeight: 312.88122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22ClN3S/c1-3-19-9-5-6-12(19)10-17-15(20)18-14-8-4-7-13(16)11(14)2/h4,7-8,12H,3,5-6,9-10H2,1-2H3,(H2,17,18,20)/p+1/t12-/m1/s1