Vitas-M small molecule compound
3,3-dimethyl-11-[1-phenyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-4-yl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK149986
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cn(nc1C12CC3CC(C2)CC(C1)C3)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 C34H38N4O MW 518.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N4O/c1-33(2)18-28-30(29(39)19-33)31(36-27-11-7-6-10-26(27)35-28)25-20-38(24-8-4-3-5-9-24)37-32(25)34-15-21-12-22(16-34)14-23(13-21)17-34/h3-11,20-23,31,35-36H,12-19H2,1-2H3InChIKey
KZOLNJOWKRZNED-UHFFFAOYSA-NSynonyms
11(3ADAMANTANYL1PHENYLPYRAZOL4YL)33DIMETHYL234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
33dimethyl11(1phenyl3(tricyclo(3311~37~)dec1yl)1Hpyrazol4yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3(1adamantyl)1phenylpyrazol4yl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8)C(=O)C1)C
InChI=1SC34H38N4Oc133(2)182830(29(39)1933)31(362711761026(27)3528)252038(248435924)3732(25)3415211222(1634)1423(1321)1734h3112023313536H1219H212H3
MFCD04221965
ZINC000009720407
ZINC000009720408
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