C21H17N5OS structure

C21H17N5OS

4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione

Also Known As: (E)-4-((4-(benzyloxy)benzylidene)amino)-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol|4-{(1E)-2-[4-(phenylmethoxy)phenyl]-1-azavinyl}-5-(2-pyridyl)-1,2,4-triazole-3 -thiol|4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol|4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

CAS: 613248-12-7
Molecular Formula C21H17N5OS
Molecular Weight 387.1154 g/mol
LogP 4.46389
Topological Polar Surface Area 68.09 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 387.1154
Monoisotopic Mass 387.1154
Heavy Atoms 28
Complexity 1118.9419

Chemical Identifiers

CAS Number 613248-12-7
SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/N3C(=NNC3=S)C4=CC=CC=N4

Product Overview

C21H17N5OS (CAS 613248-12-7), with molecular formula C21H17N5OS and molecular weight 387.1154 g/mol. IUPAC: 4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione.

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