SpectraBase Spectrum ID |
3Koz7tPKDDq |
Name |
2-[2-(1-adamantyl)-2-oxidanylidene-ethyl]sulfanyl-6-(methoxymethyl)-4-methyl-pyridine-3-carbonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H26N2O2S |
InChI |
InChI=1S/C21H26N2O2S/c1-13-3-17(11-25-2)23-20(18(13)10-22)26-12-19(24)21-7-14-4-15(8-21)6-16(5-14)9-21/h3,14-16H,4-9,11-12H2,1-2H3/t14-,15+,16-,21- |
InChIKey |
MKFPVIREYLZTHA-OFIQSVQDSA-N |
Molecular Weight |
370.511 g/mol |
SMILES |
C12(C(CSc3c(c(C)cc(n3)COC)C#N)=O)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H] |
SPLASH |
splash10-000i-3910000000-72ee0495f222481246ff |
Synonyms |
2-[2-(1-adamantyl)-2-oxo-ethyl]sulfanyl-6-(methoxymethyl)-4-methyl-pyridine-3-carbonitrile
2-[[2-(1-adamantyl)-2-keto-ethyl]thio]-6-(methoxymethyl)-4-methyl-nicotinonitrile
2-[[2-(1-adamantyl)-2-oxoethyl]thio]-6-(methoxymethyl)-4-methyl-3-pyridinecarbonitrile |
Wiley ID |
1452747 |