2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-cyano-2-methyl-pyrazol-3-yl)butanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-cyano-2-methyl-pyrazol-3-yl)butanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-cyano-2-methyl-pyrazol-3-yl)butanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(4-cyano-2-methyl-3-pyrazolyl)butanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-cyano-2-methylpyrazol-3-yl)butanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(4-cyano-2-methyl-pyrazol-3-yl)butyramide Formula: C12H16N8OS MolecularWeight: 320.37344

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C)C#N)N2C(=NN=C2SC)N

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C)C#N)N2C(=NN=C2SC)N

InChI

InChI=1S/C12H16N8OS/c1-4-8(20-11(14)17-18-12(20)22-3)10(21)16-9-7(5-13)6-15-19(9)2/h6,8H,4H2,1-3H3,(H2,14,17)(H,16,21)