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

Systemtic Name: 2-butylsulfanyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-butylsulfanyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(butylthio)-N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-butylsulfanyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(butylthio)-N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C16H18N4OS3 MolecularWeight: 378.53532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCSCC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H18N4OS3/c1-2-3-8-22-11-14(21)18-15-19-20-16(24-15)23-10-13-6-4-12(9-17)5-7-13/h4-7H,2-3,8,10-11H2,1H3,(H,18,19,21)