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

Systemtic Name: N-(2-methylphenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(2-morpholin-4-ium-4-ylethylsulfanyl)-N-(o-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(2-methylphenyl)-5-[2-(4-morpholin-4-iumyl)ethylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2-methylphenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(2-morpholin-4-ium-4-ylethylthio)-1,3,4-thiadiazol-2-yl]-(o-tolyl)amine Formula: C15H21N4OS2+ MolecularWeight: 337.48344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN=C(S2)SCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1NC2=NN=C(S2)SCC[NH+]3CCOCC3

InChI

InChI=1S/C15H20N4OS2/c1-12-4-2-3-5-13(12)16-14-17-18-15(22-14)21-11-8-19-6-9-20-10-7-19/h2-5H,6-11H2,1H3,(H,16,17)/p+1