2-(2-bromanyl-4,5-diethoxy-phenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4,5-diethoxy-phenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(2-bromo-4,5-diethoxy-phenyl)acetamide CAS Name: 2-(2-bromo-4,5-diethoxyphenyl)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(2-bromo-4,5-diethoxyphenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-2-(2-bromo-4,5-diethoxy-phenyl)acetamide Formula: C17H20BrN3O3S2 MolecularWeight: 458.393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CC(=O)NC2=NN=C(S2)SCC=C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CC(=O)NC2=NN=C(S2)SCC=C)Br)OCC

InChI

InChI=1S/C17H20BrN3O3S2/c1-4-7-25-17-21-20-16(26-17)19-15(22)9-11-8-13(23-5-2)14(24-6-3)10-12(11)18/h4,8,10H,1,5-7,9H2,2-3H3,(H,19,20,22)