5-methylsulfanyl-2-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2,4-triazol-3-amine

Systemtic Name: 5-methylsulfanyl-2-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2,4-triazol-3-amine Openeye Name: 2-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-5-methylsulfanyl-1,2,4-triazol-3-amine CAS Name: 5-(methylthio)-2-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-1,2,4-triazol-3-amine IUPAC Name: 2-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-5-methylsulfanyl-1,2,4-triazol-3-amine Traditional Name: [2-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-5-(methylthio)-1,2,4-triazol-3-yl]amine Formula: C12H12N6S3 MolecularWeight: 336.45888

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CSC1=NN(C(=N1)N)C2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C12H12N6S3/c1-19-10-14-9(13)18(17-10)11-15-16-12(21-11)20-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,13,14,17)