2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H18N4OS2 MolecularWeight: 322.44892

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

CN1C=NN=C1SCC(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C14H18N4OS2/c1-18-11-16-17-14(18)21-10-13(19)15-7-8-20-9-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,15,19)