5-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(2-bromo-4,5-diethoxy-phenyl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2-bromo-4,5-diethoxyphenyl)methylthio]-N-ethyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(2-bromo-4,5-diethoxyphenyl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(2-bromo-4,5-diethoxy-benzyl)thio]-1,3,4-thiadiazol-2-yl]-ethyl-amine Formula: C15H20BrN3O2S2 MolecularWeight: 418.3722

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCC2=CC(=C(C=C2Br)OCC)OCC

Isomeric SMILES

CCNC1=NN=C(S1)SCC2=CC(=C(C=C2Br)OCC)OCC

InChI

InChI=1S/C15H20BrN3O2S2/c1-4-17-14-18-19-15(23-14)22-9-10-7-12(20-5-2)13(21-6-3)8-11(10)16/h7-8H,4-6,9H2,1-3H3,(H,17,18)