2-N',5-N'-bis(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)thiophene-2,5-dicarbohydrazide

This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
InChI descriptor[cheminf_000113]: InChI=1S/C24H24N4O4S3/c29-21(25-27-23(31)19-11-13-5-1-3-7-15(13)33-19)17-9-10-18(35-17)22(30)26-28-24(32)20-12-14-6-2-4-8-16(14)34-20/h9-12H,1-8H2,(H,25,29)(H,26,30)(H,27,31)(H,28,32), and canonical SMILES descriptor[cheminf_000007]: O=C(c1ccc(s1)C(=O)NNC(=O)c1cc2c(s1)CCCC2)NNC(=O)c1cc2c(s1)CCCC2, and by the IUPAC name[cheminf_000107]: 2-N',5-N'-bis(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)thiophene-2,5-dicarbohydrazide.

The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:

CC(O)=O

The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-59001

The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
Melting point descriptor[CHEMINF_000256]:
Boiling point descriptor[CHEMINF_000257]:
Refractive index descriptor[CHEMINF_000253]:

The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:

CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)

CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)

CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)

CHMO:0001146 | 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)

CHMO:0001148 | 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

CHMO:0001150 | 1H--1H correlation spectroscopy (1H-1H COSY)

The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID:

Used ontologies:
CHEBI - Chemical Entities of Biological Interest
CHEMINF - chemical information ontology (information entities about chemical entities)
CHMO - Chemical Methods Ontology
OBI - Ontology for Biomedical Investigations