ethyl-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl]-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: ethyl-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl]-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: ethyl-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl]-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: ethyl-[[5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl]-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: ethyl-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl]-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: ethyl-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl]-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C20H23FN3O2S+ MolecularWeight: 388.478923

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NOC(=C1C)C2=CC=C(C=C2)F)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CC[NH+](CC1=NOC(=C1C)C2=CC=C(C=C2)F)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H22FN3O2S/c1-3-24(13-19(25)22-11-17-5-4-10-27-17)12-18-14(2)20(26-23-18)15-6-8-16(21)9-7-15/h4-10H,3,11-13H2,1-2H3,(H,22,25)/p+1