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

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,1-dimethylpropyl)acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-tert-amyl-acetamide Formula: C14H20N6OS MolecularWeight: 320.4132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSC1=NN=C(N1N)C2=CN=CC=C2

Isomeric SMILES

CCC(C)(C)NC(=O)CSC1=NN=C(N1N)C2=CN=CC=C2

InChI

InChI=1S/C14H20N6OS/c1-4-14(2,3)17-11(21)9-22-13-19-18-12(20(13)15)10-6-5-7-16-8-10/h5-8H,4,9,15H2,1-3H3,(H,17,21)