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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloranylpyridin-3-yl)ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloro-3-pyridyl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(2-chloro-3-pyridinyl)acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloropyridin-3-yl)acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(2-chloro-3-pyridyl)acetamide Formula: C9H9ClN6OS MolecularWeight: 284.72536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)NC(=O)CSC2=NNC(=N2)N

Isomeric SMILES

C1=CC(=C(N=C1)Cl)NC(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C9H9ClN6OS/c10-7-5(2-1-3-12-7)13-6(17)4-18-9-14-8(11)15-16-9/h1-3H,4H2,(H,13,17)(H3,11,14,15,16)