SpectraBase Spectrum ID |
7NonIRtFZtY |
Name |
3-(4-Chlorophenyl)-5-(benzothiazol-2-yl)carbonyl-2-(benzothiazol-2-yl)carbonyl-cyanomethylene-2,3-dihydro-1,3,4-thiadiazole |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H12ClN5O2S3 |
InChI |
InChI=1S/C26H12ClN5O2S3/c27-14-9-11-15(12-10-14)32-26(16(13-28)21(33)23-29-17-5-1-3-7-19(17)35-23)37-25(31-32)22(34)24-30-18-6-2-4-8-20(18)36-24/h1-12H/b26-16+ |
InChIKey |
YKSJMKLWIXLLMQ-WGOQTCKBSA-N |
Molecular Weight |
558.048 g/mol |
SMILES |
C1(=NN(\C(S1)=C/(C(c1nc2ccccc2s1)=O)C#N)c1ccc(cc1)Cl)C(c1nc2ccccc2s1)=O |
SPLASH |
splash10-08gi-0901020000-738916e91aded2f605fa |
Source of Spectrum |
F-53-165-6 |
Synonyms |
(2E)-3-(1,3-benzothiazol-2-yl)-2-(5-(1,3-benzothiazol-2-ylcarbonyl)-3-(4-chlorophenyl)-1,3,4-thiadiazol-2(3H)-ylidene)-3-oxopropanenitrile
3-(4-Chlorophenyl)-5-(benzothiaxol-2-yl)carbonyl-2-(benzothiazol-2-yl)carbonylcyanomethylene-2,3-dihydro-1,3,4-thiadiazole |
Wiley ID |
799885 |