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

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H11ClN6OS MolecularWeight: 346.79474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=C(N=C1)Cl)NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C14H11ClN6OS/c15-12-10(2-1-5-17-12)18-11(22)8-23-14-19-13(20-21-14)9-3-6-16-7-4-9/h1-7H,8H2,(H,18,22)(H,19,20,21)