5-[(4-bromanyl-2,6-dimethyl-phenoxy)methyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(4-bromanyl-2,6-dimethyl-phenoxy)methyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-bromo-2,6-dimethyl-phenoxy)methyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(4-bromo-2,6-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-bromo-2,6-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(4-bromo-2,6-dimethyl-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]amine Formula: C11H12BrN3OS MolecularWeight: 314.20148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=NN=C(S2)N)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=NN=C(S2)N)C)Br

InChI

InChI=1S/C11H12BrN3OS/c1-6-3-8(12)4-7(2)10(6)16-5-9-14-15-11(13)17-9/h3-4H,5H2,1-2H3,(H2,13,15)