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

Systemtic Name: 3-[cyclohexylcarbonyl-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[cyclohexanecarbonyl-[4-(4-fluorophenyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[cyclohexyl(oxo)methyl]-[4-(4-fluorophenyl)-2-thiazolyl]amino]propyl-dimethylammonium IUPAC Name: 3-[cyclohexanecarbonyl-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[cyclohexanecarbonyl-[4-(4-fluorophenyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium Formula: C21H29FN3OS+ MolecularWeight: 390.537863

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC(=CS1)C2=CC=C(C=C2)F)C(=O)C3CCCCC3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC(=CS1)C2=CC=C(C=C2)F)C(=O)C3CCCCC3

InChI

InChI=1S/C21H28FN3OS/c1-24(2)13-6-14-25(20(26)17-7-4-3-5-8-17)21-23-19(15-27-21)16-9-11-18(22)12-10-16/h9-12,15,17H,3-8,13-14H2,1-2H3/p+1