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

Systemtic Name: 2-[[4-azanyl-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]-N-[2-(methylthio)phenyl]acetamide Formula: C19H27N5OS2 MolecularWeight: 405.58058

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CSC2=NN=C(N2N)CCC3CCCCC3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CSC2=NN=C(N2N)CCC3CCCCC3

InChI

InChI=1S/C19H27N5OS2/c1-26-16-10-6-5-9-15(16)21-18(25)13-27-19-23-22-17(24(19)20)12-11-14-7-3-2-4-8-14/h5-6,9-10,14H,2-4,7-8,11-13,20H2,1H3,(H,21,25)