5-[(4-bromophenyl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(4-bromophenyl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-bromophenyl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(4-bromophenyl)methylthio]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-bromophenyl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(4-bromobenzyl)thio]-1,3,4-thiadiazol-2-yl]-(2-methoxyethyl)amine Formula: C12H14BrN3OS2 MolecularWeight: 360.29306

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC2=CC=C(C=C2)Br

Isomeric SMILES

COCCNC1=NN=C(S1)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H14BrN3OS2/c1-17-7-6-14-11-15-16-12(19-11)18-8-9-2-4-10(13)5-3-9/h2-5H,6-8H2,1H3,(H,14,15)