Vitas-M small molecule compound
1-[6-methyl-2-oxo-3-(propan-2-yl)cyclohexyl]ethane-1,1,2,2-tetracarbonitrile
Catalog ID
STK527979
SMILES CC(C1CCC(C(C1=O)C(C(C#N)C#N)(C#N)C#N)C)C
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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 C16H18N4O MW 282.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O/c1-10(2)13-5-4-11(3)14(15(13)21)16(8-19,9-20)12(6-17)7-18/h10-14H,4-5H2,1-3H3InChIKey
RXUGENCIFOVTBC-UHFFFAOYSA-NSynonyms
514215-08-81(3isopropyl6methyl2oxocyclohexyl)ethane1122tetracarbonitrile
1(6methyl2oxo3(propan2yl)cyclohexyl)ethane1122tetracarbonitrile
1(6methyl2oxo3propan2ylcyclohexyl)ethane1122tetracarbonitrile
514215088
CC1CCC(C(=O)C1C(C#N)(C#N)C(C#N)C#N)C(C)C
InChI=1SC16H18N4Oc110(2)135411(3)14(15(13)21)16(819920)12(617)718h1014H45H213H3
MFCD01304014
ZINC000000502541
ZINC000004481970
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