Chemical Compound

Oprea1_738203

CAS Registry Number496021-96-6
Oprea1_738203 chemical structure
Primary record

Oprea1_738203

CAS
496021-96-6
PubChem CID
1184213
SMILES
C1=CC=C(C=C1)C2=CSC3=C2C(=O)N4C(=N3)C5=CC=CC=C5C6=NN=NN64
Molecular Formula
C19H10N6OS
Molecular Weight
370.397
Exact Mass
370.0637
InChI
InChI=1S/C19H10N6OS/c26-19-15-14(11-6-2-1-3-7-11)10-27-18(15)20-16-12-8-4-5-9-13(12)17-21-22-23-25(17)24(16)19/h1-10H
InChIKey
IZTFFUIDQIFRAZ-UHFFFAOYSA-N
LogP
3.1671
TPSA
77.45

Names and synonyms

  • Oprea1_738203
  • IZTFFUIDQIFRAZ-UHFFFAOYSA-N
  • STL305491
  • ZINC00944621
  • AKOS001057443
  • CID1184213
  • ST50049508
  • AF-399/41114999
  • SR-01000265653
  • SR-01000265653-1
  • Z56881748
  • 496021-96-6
  • 18-Phenyl-16-thia-1,2,3,4,5,14-hexazapentacyclo[11.7.0.02,6.07,12.015,19]icosa-3,5,7,9,11,13,15(19),17-octaen-20-one
  • 11-phenyl-12H-tetraazolo[5,1-a]thieno[2',3':4,5]pyrimido[1,2-c]phthalazin-12-one
  • 11-phenyl-12H-tetrazolo[5,1-a]thieno[2',3':4,5]pyrimido[1,2-c]phthalazin-12-one
  • 11-phenyl-13,14-dihydro-1,2,3,4-tetraazolo[1',5'-3,4]phthalazino[2,1-a]thiophe no[2,3-d]pyrimidin-12-one
  • 18-phenyl-16-thia-1,2,3,4,5,14-hexaazapentacyclo[11.7.0.0^{2,6}.0^{7,12}.0^{15,19}]icosa-3,5,7(12),8,10,13,15(19),17-octaen-20-one