Vitas-M small molecule compound

4-oxo-2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile

Catalog ID
STK700055
SMILES N#CC1C(=O)NC(=C(C21CCCCC2)C#N)SCC(=O)C12CC3CC(C2)CC(C1)C3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H29N3O2S MW 423.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2S/c25-12-18-21(29)27-22(19(13-26)24(18)4-2-1-3-5-24)30-14-20(28)23-9-15-6-16(10-23)8-17(7-15)11-23/h15-18H,1-11,14H2,(H,27,29)
InChIKey
VHPREMPLSVOCHG-UHFFFAOYSA-N
Synonyms
309278-35-1
10(2(1ADAMANTYL)2OXOETHYL)SULFANYL8OXO9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
2((2((3r5r7r)adamantan1yl)2oxoethyl)thio)4oxo3azaspiro(55)undec1ene15dicarbonitrile
2((2(1ADAMANTYL)2OXOETHYL)SULFANYL)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
2(2ADAMANTANYL2OXOETHYLTHIO)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
309278351
4(2(1adamantyl)2oxoethyl)sulfanyl2oxo3azaspiro(55)undec4ene15dicarbonitrile
4oxo2((2oxo2(tricyclo(3311~37~)dec1yl)ethyl)sulfanyl)3azaspiro(55)undec1ene15dicarbonitrile
C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)C34CC5CC(C3)CC(C5)C4)C#N
InChI=1SC24H29N3O2Sc25121821(29)2722(19(1326)24(18)4213524)301420(28)23915616(1023)817(715)1123h1518H11114H2(H2729)
ZINC000004535989
ZINC000004535992

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Available files

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