Vitas-M small molecule compound
11-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK262939
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1c(C)nn(c1Cl)c1ccccc1
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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 C25H25ClN4O MW 432.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4O/c1-15-21(24(26)30(29-15)16-9-5-4-6-10-16)23-22-19(13-25(2,3)14-20(22)31)27-17-11-7-8-12-18(17)28-23/h4-12,23,27-28H,13-14H2,1-3H3InChIKey
HALUOMUJKGFJCG-UHFFFAOYSA-NSynonyms
525582-75-611(5chloro3methyl1phenyl1Hpyrazol4yl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
525582756
6(5chloro3methyl1phenylpyrazol4yl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1=NN(C(=C1C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2)Cl)C5=CC=CC=C5
InChI=1SC25H25ClN4Oc11521(24(26)30(2915)1695461016)232219(1325(23)1420(22)31)271711781218(17)2823h412232728H1314H213H3
MFCD01919328
ZINC000001414053
ZINC000001414054
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