Chemical Component Summary

Name2-[(~{E})-4-[6-(methylamino)pyridin-3-yl]but-1-en-3-ynyl]-1,3-benzothiazol-6-ol
Identifiers2-[(~{E})-4-[6-(methylamino)pyridin-3-yl]but-1-en-3-ynyl]-1,3-benzothiazol-6-ol
FormulaC17 H13 N3 O S
Molecular Weight307.37
TypeNON-POLYMER
Isomeric SMILESCNc1ccc(cn1)C#C/C=C/c2nc3ccc(cc3s2)O
InChIInChI=1S/C17H13N3OS/c1-18-16-9-6-12(11-19-16)4-2-3-5-17-20-14-8-7-13(21)10-15(14)22-17/h3,5-11,21H,1H3,(H,18,19)/b5-3+
InChIKeySNWJZYJBIVWGKZ-HWKANZROSA-N

Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count0
Bond Count37
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 73330861