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

Systemtic Name: 3-[(2-fluorophenyl)carbonyl-[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[(2-fluorobenzoyl)-[4-(p-tolyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(2-fluorophenyl)-oxomethyl]-[4-(4-methylphenyl)-2-thiazolyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(2-fluorobenzoyl)-[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[(2-fluorobenzoyl)-[4-(p-tolyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium Formula: C22H25FN3OS+ MolecularWeight: 398.516803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H24FN3OS/c1-16-9-11-17(12-10-16)20-15-28-22(24-20)26(14-6-13-25(2)3)21(27)18-7-4-5-8-19(18)23/h4-5,7-12,15H,6,13-14H2,1-3H3/p+1