cyclohexyl-[[5-[(4-fluorophenyl)methylcarbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-azanium

Systemtic Name: cyclohexyl-[[5-[(4-fluorophenyl)methylcarbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[5-[(4-fluorophenyl)methylcarbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[5-[[(4-fluorophenyl)methylamino]-oxomethyl]-1,3,4-thiadiazol-2-yl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[5-[(4-fluorophenyl)methylcarbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methylazanium Traditional Name: cyclohexyl-[[5-[(4-fluorobenzyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-ammonium Formula: C18H24FN4OS+ MolecularWeight: 363.472763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NN=C(S1)C(=O)NCC2=CC=C(C=C2)F)C3CCCCC3

Isomeric SMILES

C[NH+](CC1=NN=C(S1)C(=O)NCC2=CC=C(C=C2)F)C3CCCCC3

InChI

InChI=1S/C18H23FN4OS/c1-23(15-5-3-2-4-6-15)12-16-21-22-18(25-16)17(24)20-11-13-7-9-14(19)10-8-13/h7-10,15H,2-6,11-12H2,1H3,(H,20,24)/p+1