1-(4-fluorophenyl)-3-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]urea Openeye Name: 1-(4-fluorophenyl)-3-[(1R,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]urea CAS Name: 1-(4-fluorophenyl)-3-[(1R,2R)-1-(1-pyrrolidin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]urea IUPAC Name: 1-(4-fluorophenyl)-3-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-ylpropan-2-yl]urea Traditional Name: 1-(4-fluorophenyl)-3-[(1R,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]urea Formula: C18H23FN3OS+ MolecularWeight: 348.458123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCCC2)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C[C@H]([C@H](C1=CC=CS1)[NH+]2CCCC2)NC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3OS/c1-13(20-18(23)21-15-8-6-14(19)7-9-15)17(16-5-4-12-24-16)22-10-2-3-11-22/h4-9,12-13,17H,2-3,10-11H2,1H3,(H2,20,21,23)/p+1/t13-,17-/m1/s1