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

Systemtic Name: 5-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-bromo-4-methoxyphenyl)methylthio]-N-methyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-bromo-4-methoxy-benzyl)thio]-1,3,4-thiadiazol-2-yl]-methyl-amine Formula: C11H12BrN3OS2 MolecularWeight: 346.26648

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SCC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CNC1=NN=C(S1)SCC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C11H12BrN3OS2/c1-13-10-14-15-11(18-10)17-6-7-3-4-9(16-2)8(12)5-7/h3-5H,6H2,1-2H3,(H,13,14)