SpectraBase Spectrum ID |
KnLYR12IgGd |
Name |
8-chloranyl-6-(4-methylpiperazin-1-yl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H20ClN3S |
InChI |
InChI=1S/C17H20ClN3S/c1-19-7-9-20(10-8-19)15-12-21-6-2-3-17(21)22-16-5-4-13(18)11-14(15)16/h2-6,11,15H,7-10,12H2,1H3 |
InChIKey |
YQXNPUPTPJOJOV-UHFFFAOYSA-N |
Molecular Weight |
333.881 g/mol |
SMILES |
c12Sc3c(C(C[n]2ccc1)N1CCN(CC1)C)cc(cc3)Cl |
SPLASH |
splash10-001i-0091000000-bdfe1e9a1e6b696fff17 |
Source of Spectrum |
F2-41-3770-3 |
Synonyms |
8-chloro-6-(4-methyl-1-piperazinyl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine
8-chloro-6-(4-methylpiperazin-1-yl)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine
8-chloro-6-(4-methylpiperazino)-5,6-dihydropyrrolo[2,1-b][1,3]benzothiazepine |
Wiley ID |
1599821 |