Vitas-M small molecule compound

4-[(2,5-dichlorophenoxy)methyl]-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]benzamide

Catalog ID
STK301837
SMILES Clc1ccc(c(c1)OCc1ccc(cc1)C(=O)Nc1ccn(n1)C12CC3CC(C2)CC(C1)C3)Cl

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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 C27H27Cl2N3O2 MW 496.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27Cl2N3O2/c28-22-5-6-23(29)24(12-22)34-16-17-1-3-21(4-2-17)26(33)30-25-7-8-32(31-25)27-13-18-9-19(14-27)11-20(10-18)15-27/h1-8,12,18-20H,9-11,13-16H2,(H,30,31,33)
InChIKey
XDMLVADWIYTBCR-UHFFFAOYSA-N
Synonyms
512810-29-6
4((25dichlorophenoxy)methyl)N(1(tricyclo(3311~37~)dec1yl)1Hpyrazol3yl)benzamide
512810296
C1C2CC3CC1CC(C2)(C3)N4C=CC(=N4)NC(=O)C5=CC=C(C=C5)COC6=C(C=CC(=C6)Cl)Cl
InChI=1SC27H27Cl2N3O2c28225623(29)24(1222)3416171321(4217)26(33)30257832(3125)271318919(1427)1120(1018)1527h18121820H9111316H2(H303133)
MFCD03465857
N(1(1ADAMANTYL)1HPYRAZOL3YL)4((25DICHLOROPHENOXY)METHYL)BENZAMIDE
N(1(1ADAMANTYL)PYRAZOL3YL)4((25DICHLOROPHENOXY)METHYL)BENZAMIDE
ZINC000008454852
ZINC08454852
ZINC8454852

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Available files

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