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

Systemtic Name: 2-(4-bromanylphenoxy)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C21H16BrN3O2S2 MolecularWeight: 486.40464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)NC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)NC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O2S2/c22-16-8-10-17(11-9-16)27-12-19(26)23-20-24-25-21(29-20)28-13-15-6-3-5-14-4-1-2-7-18(14)15/h1-11H,12-13H2,(H,23,24,26)