2-bromanyl-3,4,5-trimethoxy-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 2-bromanyl-3,4,5-trimethoxy-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 2-bromo-3,4,5-trimethoxy-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 2-bromo-3,4,5-trimethoxy-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-bromo-3,4,5-trimethoxy-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 2-bromo-3,4,5-trimethoxy-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C13H14BrN3O4S2 MolecularWeight: 420.30196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=NN=C(S2)SC)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=NN=C(S2)SC)Br)OC)OC

InChI

InChI=1S/C13H14BrN3O4S2/c1-19-7-5-6(8(14)10(21-3)9(7)20-2)11(18)15-12-16-17-13(22-4)23-12/h5H,1-4H3,(H,15,16,18)