1-(2,4-dichlorophenyl)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Formula: C14H20Cl2N3S+ MolecularWeight: 333.2997

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19Cl2N3S/c1-2-19-7-3-4-11(19)9-17-14(20)18-13-6-5-10(15)8-12(13)16/h5-6,8,11H,2-4,7,9H2,1H3,(H2,17,18,20)/p+1/t11-/m0/s1