SpectraBase Spectrum ID |
Ll63l5nNavt |
Name |
7-Chloro-2,3-dihydro-5-phenyl-3-[(pyrrolyl-2)methylene]-1H-1,4-benzodiazepin-2-one |
CAS Registry Number |
55056-40-1 |
Comments |
Structure changed after expert review |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H14ClN3O |
InChI |
InChI=1S/C20H14ClN3O/c21-14-8-9-17-16(11-14)19(13-5-2-1-3-6-13)23-18(20(25)24-17)12-15-7-4-10-22-15/h1-12,22H,(H,24,25)/b18-12+ |
InChIKey |
QXGDKXYOULVCKD-LDADJPATSA-N |
Molecular Weight |
347.805 g/mol |
SMILES |
N1C(\C(=C/c2ccc[nH]2)N=C(c2c1ccc(c2)Cl)c1ccccc1)=O |
SPLASH |
splash10-0002-8219000000-5093a4df56177cc518d0 |
Source of Spectrum |
W5-1989-36680-28856 |
Synonyms |
(3E)-7-Chloro-5-phenyl-3-(1H-pyrrol-2-ylmethylene)-1,3-dihydro-2H-1,4-benzodiazepin-2-one |
Wiley ID |
1340050 |