N-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: N-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-[(3-bromophenyl)methylthio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-[5-[(3-bromophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-[5-[(3-bromobenzyl)thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C12H12BrN3OS2 MolecularWeight: 358.27718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NN=C(S1)SCC2=CC(=CC=C2)Br

Isomeric SMILES

CCC(=O)NC1=NN=C(S1)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H12BrN3OS2/c1-2-10(17)14-11-15-16-12(19-11)18-7-8-4-3-5-9(13)6-8/h3-6H,2,7H2,1H3,(H,14,15,17)