N-(3-chloranyl-4-methyl-phenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(3-chloro-4-methylphenyl)-5-[2-(4-morpholin-4-iumyl)ethylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-chloro-4-methylphenyl)-5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: (3-chloro-4-methyl-phenyl)-[5-(2-morpholin-4-ium-4-ylethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C15H20ClN4OS2+ MolecularWeight: 371.9285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC[NH+]3CCOCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC[NH+]3CCOCC3)Cl

InChI

InChI=1S/C15H19ClN4OS2/c1-11-2-3-12(10-13(11)16)17-14-18-19-15(23-14)22-9-6-20-4-7-21-8-5-20/h2-3,10H,4-9H2,1H3,(H,17,18)/p+1