Vitas-M small molecule compound

11-{3-[(4-fluorophenoxy)methyl]-4-methoxyphenyl}-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STL023676
SMILES COc1ccc(cc1COc1ccc(cc1)F)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 C29H29FN2O3 MW 472.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29FN2O3/c1-29(2)15-24-27(25(33)16-29)28(32-23-7-5-4-6-22(23)31-24)18-8-13-26(34-3)19(14-18)17-35-21-11-9-20(30)10-12-21/h4-14,28,31-32H,15-17H2,1-3H3
InChIKey
GUMREDIMNGJOEM-UHFFFAOYSA-N
Synonyms
312621-86-6
11(3((4fluorophenoxy)methyl)4methoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312621866
6(3((4fluorophenoxy)methyl)4methoxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC(=C(C=C4)OC)COC5=CC=C(C=C5)F)C(=O)C1)C
InChI=1SC29H29FN2O3c129(2)152427(25(33)1629)28(3223754622(23)3124)1881326(343)19(1418)17352111920(30)101221h414283132H1517H213H3
MFCD01921813
ZINC000009085920
ZINC000009086401

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Available files

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