CHEBI:92748 - 5-(4-dibenzothiophenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(4-dibenzothiophenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine
ChEBI ID CHEBI:92748
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H12N6S3
Net Charge 0
Average Mass 432.548
Monoisotopic Mass 432.02856
InChI InChI=1S/C20H12N6S3/c1-26-20(23-24-25-26)29-19-16-14(9-27-18(16)21-10-22-19)13-7-4-6-12-11-5-2-3-8-15(11)28-17(12)13/h2-10H,1H3
InChIKey DEVPNNKKGPZYFO-UHFFFAOYSA-N
SMILES CN1C(=NN=N1)SC2=NC=NC3=C2C(=CS3)C4=CC=CC5=C4SC6=CC=CC=C56
ChEBI Ontology
Outgoing 5-(4-dibenzothiophenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine (CHEBI:92748) is a dibenzothiophenes (CHEBI:23684)
5-(4-dibenzothiophenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine (CHEBI:92748) is a thienopyrimidine (CHEBI:143212)
Manual Xref Database
LSM-2943 LINCS
View more database links
Last Modified
06 March 2019