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

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloranylpyridin-3-yl)ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chloro-3-pyridyl)acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(2-chloro-3-pyridinyl)acetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloropyridin-3-yl)acetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-chloro-3-pyridyl)acetamide Formula: C14H12ClN7OS MolecularWeight: 361.80938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN=C(N2N)SCC(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=NN=C(N2N)SCC(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C14H12ClN7OS/c15-12-10(4-2-6-18-12)19-11(23)8-24-14-21-20-13(22(14)16)9-3-1-5-17-7-9/h1-7H,8,16H2,(H,19,23)