Vitas-M small molecule compound

3-(4-ethoxy-3-methoxyphenyl)-11-(3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK403349
SMILES CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cccc(c1)OC

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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 C29H30N2O4 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O4/c1-4-35-26-13-12-18(17-27(26)34-3)20-15-24-28(25(32)16-20)29(19-8-7-9-21(14-19)33-2)31-23-11-6-5-10-22(23)30-24/h5-14,17,20,29-31H,4,15-16H2,1-3H3
InChIKey
BQHPUUQBTIQNJQ-UHFFFAOYSA-N
Synonyms

3(4ethoxy3methoxyphenyl)11(3methoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4ethoxy3methoxyphenyl)6(3methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=CC=C5)OC)C(=O)C2)OC
InChI=1SC29H30N2O4c143526131218(1727(26)343)20152428(25(32)1620)29(1987921(1419)332)312311651022(23)3024h51417202931H41516H213H3
MFCD03489165
ZINC000001076929
ZINC000001076939

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Available files

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