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loading...| Preferred Name |
7-(2-chloro-6-fluorophenyl)-5-methyl-6,7-dihydro-1H-1,4-diazepine-2,3-dicarbonitrile |
| ID |
http://purl.obolibrary.org/obo/CHEBI_116221 |
| charge |
0 |
| database_cross_reference |
LINCS:LSM-27677 |
| formula |
C14H10ClFN4 |
| has_obo_namespace |
chebi_ontology |
| id |
CHEBI:116221 |
| in_subset | |
| inchi |
InChI=1S/C14H10ClFN4/c1-8-5-11(14-9(15)3-2-4-10(14)16)20-13(7-18)12(6-17)19-8/h2-4,11,20H,5H2,1H3 |
| inchikey |
JTHRQQGJOBUXAL-UHFFFAOYSA-N |
| label |
7-(2-chloro-6-fluorophenyl)-5-methyl-6,7-dihydro-1H-1,4-diazepine-2,3-dicarbonitrile |
| mass |
288.708 |
| monoisotopicmass |
288.05780 |
| notation |
CHEBI:116221 |
| prefLabel |
7-(2-chloro-6-fluorophenyl)-5-methyl-6,7-dihydro-1H-1,4-diazepine-2,3-dicarbonitrile |
| smiles |
CC1=NC(=C(NC(C1)C2=C(C=CC=C2Cl)F)C#N)C#N |
| treeView | |
| subClassOf |
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