![N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)isonicotinamide](/api/spectrum/7V69VwJWFek/structure.png?h=300&w=458 "N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)isonicotinamide")
| SpectraBase Compound ID | 5UDj5AqF4S2 |
|---|---|
| InChI | InChI=1S/C17H17N3OS/c18-11-14-13-5-3-1-2-4-6-15(13)22-17(14)20-16(21)12-7-9-19-10-8-12/h7-10H,1-6H2,(H,20,21) |
| InChIKey | HDOUSKZYWLCSRD-UHFFFAOYSA-N |
| Mol Weight | 311.4 g/mol |
| Molecular Formula | C17H17N3OS |
| Exact Mass | 311.109233 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7V69VwJWFek |
|---|---|
| Name | N-(3-Cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)isonicotinamide |
| CAS Registry Number | 303138-42-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H17N3OS |
| InChI | InChI=1S/C17H17N3OS/c18-11-14-13-5-3-1-2-4-6-15(13)22-17(14)20-16(21)12-7-9-19-10-8-12/h7-10H,1-6H2,(H,20,21) |
| InChIKey | HDOUSKZYWLCSRD-UHFFFAOYSA-N |
| Molecular Weight | 311.403 g/mol |
| SMILES | N(C(=O)c1ccncc1)c1sc2c(c1C#N)CCCCCC2 |
| SPLASH | splash10-0a4i-4921000000-e49898ccca5634c35d7a |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-4-pyridinecarboxamide N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)isonicotinamide N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)pyridine-4-carboxamide Pyridine-4-carboxamide, N-(4,5,6,7,8,9-hexahydro-3-cyano-cycloocta[b]thien-2-yl)- |
| Wiley ID | 1426246 |