N-(3-fluorophenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-fluorophenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-fluorophenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(3-fluorophenyl)-5-[2-(4-morpholin-4-iumyl)ethylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-fluorophenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: (3-fluorophenyl)-[5-(2-morpholin-4-ium-4-ylethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C14H18FN4OS2+ MolecularWeight: 341.447323

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NN=C(S2)NC3=CC(=CC=C3)F

Isomeric SMILES

C1COCC[NH+]1CCSC2=NN=C(S2)NC3=CC(=CC=C3)F

InChI

InChI=1S/C14H17FN4OS2/c15-11-2-1-3-12(10-11)16-13-17-18-14(22-13)21-9-6-19-4-7-20-8-5-19/h1-3,10H,4-9H2,(H,16,17)/p+1