N-(5-chloranylquinolin-8-yl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-chloranylquinolin-8-yl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-8-quinolyl)-2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-chloro-8-quinolinyl)-2-[[4-phenyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-chloroquinolin-8-yl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-8-quinolyl)-2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H17ClN6OS MolecularWeight: 472.94938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C4C(=C(C=C3)Cl)C=CC=N4)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C4C(=C(C=C3)Cl)C=CC=N4)C5=CN=CC=C5

InChI

InChI=1S/C24H17ClN6OS/c25-19-10-11-20(22-18(19)9-5-13-27-22)28-21(32)15-33-24-30-29-23(16-6-4-12-26-14-16)31(24)17-7-2-1-3-8-17/h1-14H,15H2,(H,28,32)