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

Systemtic Name: cyclohexyl-[[5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[5-[(4-fluoroanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methylazanium Traditional Name: cyclohexyl-[[5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl]-methyl-ammonium Formula: C17H22FN4OS+ MolecularWeight: 349.446183

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NN=C(S1)C(=O)NC2=CC=C(C=C2)F)C3CCCCC3

Isomeric SMILES

C[NH+](CC1=NN=C(S1)C(=O)NC2=CC=C(C=C2)F)C3CCCCC3

InChI

InChI=1S/C17H21FN4OS/c1-22(14-5-3-2-4-6-14)11-15-20-21-17(24-15)16(23)19-13-9-7-12(18)8-10-13/h7-10,14H,2-6,11H2,1H3,(H,19,23)/p+1