3-[ethanoyl-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[ethanoyl-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[acetyl-[4-(4-fluorophenyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[acetyl-[4-(4-fluorophenyl)-2-thiazolyl]amino]propyl-dimethylammonium IUPAC Name: 3-[acetyl-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[acetyl-[4-(4-fluorophenyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium Formula: C16H21FN3OS+ MolecularWeight: 322.420843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCC[NH+](C)C)C1=NC(=CS1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)N(CCC[NH+](C)C)C1=NC(=CS1)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H20FN3OS/c1-12(21)20(10-4-9-19(2)3)16-18-15(11-22-16)13-5-7-14(17)8-6-13/h5-8,11H,4,9-10H2,1-3H3/p+1