5-[2-(4-bromanylphenoxy)ethylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(4-bromanylphenoxy)ethylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[2-(4-bromophenoxy)ethylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(4-bromophenoxy)ethylthio]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[2-(4-bromophenoxy)ethylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[2-(4-bromophenoxy)ethylthio]-1,3,4-thiadiazol-2-yl]-(4-methoxyphenyl)amine Formula: C17H16BrN3O2S2 MolecularWeight: 438.36184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCCOC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H16BrN3O2S2/c1-22-14-8-4-13(5-9-14)19-16-20-21-17(25-16)24-11-10-23-15-6-2-12(18)3-7-15/h2-9H,10-11H2,1H3,(H,19,20)