Vitas-M small molecule compound
11-(2-butoxyphenyl)-3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK067708
SMILES CCCCOc1ccccc1C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)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 C29H29ClN2O2 MW 473.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29ClN2O2/c1-2-3-16-34-27-11-7-4-8-22(27)29-28-25(31-23-9-5-6-10-24(23)32-29)17-20(18-26(28)33)19-12-14-21(30)15-13-19/h4-15,20,29,31-32H,2-3,16-18H2,1H3InChIKey
MKAKNNQSPBLZHN-UHFFFAOYSA-NSynonyms
312623-02-211(2butoxyphenyl)3(4chlorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312623022
6(2butoxyphenyl)9(4chlorophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC5=CC=CC=C5N2
CCCCOc1ccccc1C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC29H29ClN2O2c1231634271174822(27)292825(31239561024(23)3229)1720(1826(28)33)19121421(30)151319h41520293132H231618H21H3
MFCD01873704
STK067708
ZINC000004065128
ZINC000004065141
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