2-(4-bromanylphenoxy)-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C18H13BrN4O2S2 MolecularWeight: 461.35542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(S2)NC(=O)COC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(S2)NC(=O)COC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C18H13BrN4O2S2/c19-14-5-7-15(8-6-14)25-10-16(24)21-17-22-23-18(27-17)26-11-13-3-1-12(9-20)2-4-13/h1-8H,10-11H2,(H,21,22,24)