Vitas-M small molecule compound

methyl [3,3-dimethyl-1-oxo-11-(2,3,4-trimethoxyphenyl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate

Catalog ID
STK320628
SMILES COC(=O)CN1C(C2=C(Nc3c1cccc3)CC(CC2=O)(C)C)c1ccc(c(c1OC)OC)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 C27H32N2O6 MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O6/c1-27(2)13-18-23(20(30)14-27)24(16-11-12-21(32-3)26(35-6)25(16)34-5)29(15-22(31)33-4)19-10-8-7-9-17(19)28-18/h7-12,24,28H,13-15H2,1-6H3
InChIKey
OQLSKTRDNRRNDC-UHFFFAOYSA-N
Synonyms
895362-20-6
895362206
CC1(CC2=C(C(N(C3=CC=CC=C3N2)CC(=O)OC)C4=C(C(=C(C=C4)OC)OC)OC)C(=O)C1)C
InChI=1SC27H32N2O6c127(2)131823(20(30)1427)24(16111221(323)26(356)25(16)345)29(1522(31)334)191087917(19)2818h7122428H1315H216H3
methyl(33dimethyl1oxo11(234trimethoxyphenyl)1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)acetate
METHYL2(33DIMETHYL1OXO11(234TRIMETHOXYPHENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL)ACETATE
methyl2(33dimethyl1oxo11(234trimethoxyphenyl)34dihydro1Hdibenzo(be)(14)diazepin10(2H5H11H)yl)acetate
methyl2(99dimethyl7oxo6(234trimethoxyphenyl)681011tetrahydrobenzo(b)(14)benzodiazepin5yl)acetate
MFCD07642578
ZINC000009130351
ZINC000009130352

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Available files

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