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

Systemtic Name: 2-[[4-azanyl-5-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-pentyl-ethanamide Openeye Name: 2-[[4-amino-5-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-pentyl-acetamide CAS Name: 2-[[4-amino-5-(3,5-dimethyl-1-pyrazolyl)-1,2,4-triazol-3-yl]thio]-N-pentylacetamide IUPAC Name: 2-[[4-amino-5-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-pentylacetamide Traditional Name: 2-[[4-amino-5-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-3-yl]thio]-N-amyl-acetamide Formula: C14H23N7OS MolecularWeight: 337.44372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NN=C(N1N)N2C(=CC(=N2)C)C

Isomeric SMILES

CCCCCNC(=O)CSC1=NN=C(N1N)N2C(=CC(=N2)C)C

InChI

InChI=1S/C14H23N7OS/c1-4-5-6-7-16-12(22)9-23-14-18-17-13(20(14)15)21-11(3)8-10(2)19-21/h8H,4-7,9,15H2,1-3H3,(H,16,22)