Vitas-M small molecule compound

4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione

Catalog ID
STK854346
SMILES COc1ccc(cc1C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-13(2)20-22(26)23(21(25)15-7-5-6-8-19(15)28-20)12-17(24)16-11-14(3)9-10-18(16)27-4/h5-11,13,20H,12H2,1-4H3
InChIKey
PMQYNYUNEYSCIK-UHFFFAOYSA-N
Synonyms
903186-26-5
2ISOPROPYL4(2(2METHOXY5METHYLPHENYL)2OXOETHYL)BENZO(F)(14)OXAZEPINE35(2H4H)DIONE
4(2(2METHOXY5METHYLPHENYL)2OXOETHYL)2(METHYLETHYL)2HBENZO(F)14OXAZAPERHYDROEPINE35DIONE
4(2(2methoxy5methylphenyl)2oxoethyl)2(propan2yl)14benzoxazepine35(2H4H)dione
4(2(2methoxy5methylphenyl)2oxoethyl)2propan2yl14benzoxazepine35dione
903186265
CC1=CC(=C(C=C1)OC)C(=O)CN2C(=O)C(OC3=CC=CC=C3C2=O)C(C)C
InChI=1SC22H23NO5c113(2)2022(26)23(21(25)15756819(15)2820)1217(24)161114(3)91018(16)274h5111320H12H214H3
MFCD08286560
ZINC000006669724
ZINC000006669725

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Available files

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