Vitas-M small molecule compound
N-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-4-[(3,4-dimethylphenoxy)methyl]benzamide
Catalog ID
STK302864
SMILES O=C(c1ccc(cc1)COc1ccc(c(c1)C)C)Nc1cccc(c1)Cn1nc(c(c1C)Br)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 C28H28BrN3O2 MW 518.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28BrN3O2/c1-18-8-13-26(14-19(18)2)34-17-22-9-11-24(12-10-22)28(33)30-25-7-5-6-23(15-25)16-32-21(4)27(29)20(3)31-32/h5-15H,16-17H2,1-4H3,(H,30,33)InChIKey
ZWFIFRAWELEQPM-UHFFFAOYSA-NSynonyms
1005616-11-41005616114
CC1=C(C=C(C=C1)OCC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)CN4C(=C(C(=N4)C)Br)C)C
InChI=1SC28H28BrN3O2c11881326(1419(18)2)34172291124(121022)28(33)302575623(1525)163221(4)27(29)20(3)3132h515H1617H214H3(H3033)
MFCD04048698
N(3((4bromo35dimethyl1Hpyrazol1yl)methyl)phenyl)4((34dimethylphenoxy)methyl)benzamide
N(3((4BROMO35DIMETHYLPYRAZOL1YL)METHYL)PHENYL)4((34DIMETHYLPHENOXY)METHYL)BENZAMIDE
ZINC000002747774
ZINC02747774
ZINC2747774
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