N-(5-chloranylpyridin-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H14ClN5OS MolecularWeight: 359.83326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)Cl)SC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=NC=C(C=C1)Cl)SC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C16H14ClN5OS/c1-11(15(23)20-14-8-7-12(17)9-18-14)24-16-21-19-10-22(16)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,20,23)