2-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole

Systemtic Name: 2-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole Openeye Name: 2-[(4-bromo-2,5-dimethoxy-phenyl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole CAS Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methylthio]-5-methyl-1,3,4-thiadiazole IUPAC Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methylsulfanyl]-5-methyl-1,3,4-thiadiazole Traditional Name: 2-[(4-bromo-2,5-dimethoxy-benzyl)thio]-5-methyl-1,3,4-thiadiazole Formula: C12H13BrN2O2S2 MolecularWeight: 361.27782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC2=CC(=C(C=C2OC)Br)OC

Isomeric SMILES

CC1=NN=C(S1)SCC2=CC(=C(C=C2OC)Br)OC

InChI

InChI=1S/C12H13BrN2O2S2/c1-7-14-15-12(19-7)18-6-8-4-11(17-3)9(13)5-10(8)16-2/h4-5H,6H2,1-3H3