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

Systemtic Name: 5-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(2-bromo-4,5-diethoxy-phenyl)methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2-bromo-4,5-diethoxyphenyl)methylthio]-N-methyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(2-bromo-4,5-diethoxyphenyl)methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(2-bromo-4,5-diethoxy-benzyl)thio]-1,3,4-thiadiazol-2-yl]-methyl-amine Formula: C14H18BrN3O2S2 MolecularWeight: 404.34562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CSC2=NN=C(S2)NC)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CSC2=NN=C(S2)NC)Br)OCC

InChI

InChI=1S/C14H18BrN3O2S2/c1-4-19-11-6-9(10(15)7-12(11)20-5-2)8-21-14-18-17-13(16-3)22-14/h6-7H,4-5,8H2,1-3H3,(H,16,17)