Vitas-M small molecule compound

N'-({3-[(3,4-dimethylphenoxy)methyl]phenyl}carbonyl)tricyclo[3.3.1.1~3,7~]decane-1-carbohydrazide

Catalog ID
STK959158
SMILES O=C(C12CC3CC(C2)CC(C1)C3)NNC(=O)c1cccc(c1)COc1ccc(c(c1)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 C27H32N2O3 MW 432.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O3/c1-17-6-7-24(8-18(17)2)32-16-19-4-3-5-23(12-19)25(30)28-29-26(31)27-13-20-9-21(14-27)11-22(10-20)15-27/h3-8,12,20-22H,9-11,13-16H2,1-2H3,(H,28,30)(H,29,31)
InChIKey
SVIOSTNORXUBHS-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)OCC2=CC=CC(=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4)C
InChI=1SC27H32N2O3c1176724(818(17)2)32161943523(1219)25(30)282926(31)271320921(1427)1122(1020)1527h38122022H9111316H212H3(H2830)(H2931)
N((3((34dimethylphenoxy)methyl)phenyl)carbonyl)tricyclo(3311~37~)decane1carbohydrazide
N(3((34dimethylphenoxy)methyl)benzoyl)adamantane1carbohydrazide
ZINC000015931202
ZINC15931202

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.