| SpectraBase Spectrum ID |
2Yar0MSF9HR |
| Name |
17,17,18,18-tetradehydro-8-cyano-1,10-bis(p-tolylsulphonyl0-1,10-diaza[2](1,3)benzeno[2](1,2)benzeno[2](1,2)benzenophane |
| Alternate Name(s) |
3,18-bis[(4-methylphenyl)sulfonyl]-3,18-diazatetracyclo[18.3.1.0(4,9).0(12,17)]tetracosa-1(24),4,6,8,12,14,16,20,22-nonaen-10-yne-24-carbonitrile |
| CAS Registry Number |
131298-27-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H29N3O4S2 |
| InChI |
InChI=1S/C37H29N3O4S2/c1-27-14-20-33(21-15-27)45(41,42)39-25-31-10-7-11-32(35(31)24-38)26-40(46(43,44)34-22-16-28(2)17-23-34)37-13-6-4-9-30(37)19-18-29-8-3-5-12-36(29)39/h3-17,20-23H,25-26H2,1-2H3 |
| InChIKey |
PYRUAUPUZCORCR-UHFFFAOYSA-N |
| Molecular Weight |
643.776 g/mol |
| SMILES |
C1N(S(c2ccc(cc2)C)(=O)=O)c2c(C#Cc3c(N(Cc4c(c1ccc4)C#N)S(c1ccc(cc1)C)(=O)=O)cccc3)cccc2 |
| SPLASH |
splash10-00di-0001902000-c3a17694bdcff3c2198c |
| Source of Spectrum |
K-124-1226-7 |
| Wiley ID |
1412788 |
benzeno[2](1,2)benzeno[2](1,2)benzenophane](/api/spectrum/2Yar0MSF9HR/structure.png?h=300&w=458 "17,17,18,18-tetradehydro-8-cyano-1,10-bis(p-tolylsulphonyl0-1,10-diaza[2](1,3)benzeno[2](1,2)benzeno[2](1,2)benzenophane")
