2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[2-(4-fluorophenyl)thiazole-4-carbonyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[2-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[2-(4-fluorophenyl)thiazole-4-carbonyl]amino]ethyl-diisopropyl-ammonium Formula: C18H25FN3OS+ MolecularWeight: 350.474003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=CSC(=N1)C2=CC=C(C=C2)F)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=CSC(=N1)C2=CC=C(C=C2)F)C(C)C

InChI

InChI=1S/C18H24FN3OS/c1-12(2)22(13(3)4)10-9-20-17(23)16-11-24-18(21-16)14-5-7-15(19)8-6-14/h5-8,11-13H,9-10H2,1-4H3,(H,20,23)/p+1