2-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1,3,4-thiadiazole

Systemtic Name: 2-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1,3,4-thiadiazole Openeye Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methylthio]-1,3,4-thiadiazole IUPAC Name: 2-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylthio]-1,3,4-thiadiazole Formula: C13H10BrN3OS3 MolecularWeight: 400.337

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NN=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NN=CS3

InChI

InChI=1S/C13H10BrN3OS3/c1-18-11-3-2-8(14)4-10(11)12-16-9(5-19-12)6-20-13-17-15-7-21-13/h2-5,7H,6H2,1H3