2-[[4-azanyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-amino-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide CAS Name: 2-[[4-amino-5-[[4-(methylthio)phenyl]methylthio]-1,2,4-triazol-3-yl]thio]-N,N-diethylacetamide IUPAC Name: 2-[[4-amino-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[[4-amino-5-[[4-(methylthio)benzyl]thio]-1,2,4-triazol-3-yl]thio]-N,N-diethyl-acetamide Formula: C16H23N5OS3 MolecularWeight: 397.58172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NN=C(N1N)SCC2=CC=C(C=C2)SC

Isomeric SMILES

CCN(CC)C(=O)CSC1=NN=C(N1N)SCC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H23N5OS3/c1-4-20(5-2)14(22)11-25-16-19-18-15(21(16)17)24-10-12-6-8-13(23-3)9-7-12/h6-9H,4-5,10-11,17H2,1-3H3