Vitas-M small molecule compound
4-{[2-(2,3-dimethylcyclohexyl)-3-oxo-2,3,4,5,6,7-hexahydro-1H-isoindol-1-yl]amino}benzonitrile
Catalog ID
STK065010
SMILES N#Cc1ccc(cc1)NC1N(C2CCCC(C2C)C)C(=O)C2=C1CCCC2
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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 C23H29N3O MW 363.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O/c1-15-6-5-9-21(16(15)2)26-22(19-7-3-4-8-20(19)23(26)27)25-18-12-10-17(14-24)11-13-18/h10-13,15-16,21-22,25H,3-9H2,1-2H3InChIKey
DOLAWJXGFDDMGH-UHFFFAOYSA-NSynonyms
4((2(23dimethylcyclohexyl)3oxo234567hexahydro1Hisoindol1yl)amino)benzonitrile
4((2(23dimethylcyclohexyl)3oxo4567tetrahydro1Hisoindol1yl)amino)benzonitrile
CC1CCCC(C1C)N2C(C3=C(C2=O)CCCC3)NC4=CC=C(C=C4)C#N
InChI=1SC23H29N3Oc11565921(16(15)2)2622(19734820(19)23(26)27)2518121017(1424)111318h10131516212225H39H212H3
MFCD11851056
N#Cc1ccc(cc1)NC1N(C2CCCC(C2C)C)C(=O)C2=C1CCCC2
STK065010
ZINC000009553817
ZINC000239038634
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