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

Systemtic Name: 1-(4-fluorophenyl)-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea CAS Name: 1-(4-fluorophenyl)-3-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Formula: C17H21FN3OS+ MolecularWeight: 334.431543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20FN3OS/c18-13-5-7-14(8-6-13)20-17(23)19-12-15(16-4-3-11-22-16)21-9-1-2-10-21/h3-8,11,15H,1-2,9-10,12H2,(H2,19,20,23)/p+1/t15-/m0/s1