1-(2,4-dichlorophenyl)-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Formula: C17H20Cl2N3OS+ MolecularWeight: 385.3312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=S)NC2=C(C=C(C=C2)Cl)Cl)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=S)NC2=C(C=C(C=C2)Cl)Cl)C3=CC=CO3

InChI

InChI=1S/C17H19Cl2N3OS/c18-12-5-6-14(13(19)10-12)21-17(24)20-11-15(16-4-3-9-23-16)22-7-1-2-8-22/h3-6,9-10,15H,1-2,7-8,11H2,(H2,20,21,24)/p+1/t15-/m0/s1