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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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