Vitas-M small molecule compound

11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK022665
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)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 C30H31ClN2O3 MW 503.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31ClN2O3/c1-4-35-27-15-20(11-14-26(27)36-18-19-9-12-21(31)13-10-19)29-28-24(16-30(2,3)17-25(28)34)32-22-7-5-6-8-23(22)33-29/h5-15,29,32-33H,4,16-18H2,1-3H3
InChIKey
HHTUVXPNMJHIAL-UHFFFAOYSA-N
Synonyms
525582-70-1
11(4((4chlorobenzyl)oxy)3ethoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
525582701
6(4((4chlorophenyl)methoxy)3ethoxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2)OCC5=CC=C(C=C5)Cl
CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C
InChI=1SC30H31ClN2O3c1435271520(111426(27)36181991221(31)131019)292824(1630(23)1725(28)34)3222756823(22)3329h515293233H41618H213H3
MFCD03194923
STK022665
ZINC000008986611
ZINC000008986614

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Available files

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