(3R)-3-(3-fluorophenyl)-4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-3-(3-fluorophenyl)-4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-2-one Openeye Name: (3R)-3-(3-fluorophenyl)-4-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperazin-4-ium-2-one CAS Name: (3R)-3-(3-fluorophenyl)-4-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl]-2-piperazin-4-iumone IUPAC Name: (3R)-3-(3-fluorophenyl)-4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-2-one Traditional Name: (3R)-3-(3-fluorophenyl)-4-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperazin-4-ium-2-one Formula: C19H19FN3O2S+ MolecularWeight: 372.436463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCNC(=O)C3C4=CC(=CC=C4)F

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCNC(=O)[C@H]3C4=CC(=CC=C4)F

InChI

InChI=1S/C19H18FN3O2S/c1-12-15(22-19(25-12)16-6-3-9-26-16)11-23-8-7-21-18(24)17(23)13-4-2-5-14(20)10-13/h2-6,9-10,17H,7-8,11H2,1H3,(H,21,24)/p+1/t17-/m1/s1