Vitas-M small molecule compound

N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-4-(methylsulfanyl)butanamide

Catalog ID
STL567539
SMILES CSCCC(n1c(O)nc2c(c1=O)cccc2)C(=O)Nc1ccc2c(c1)OCCCO2

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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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-31-12-9-17(25-21(27)15-5-2-3-6-16(15)24-22(25)28)20(26)23-14-7-8-18-19(13-14)30-11-4-10-29-18/h2-3,5-8,13,17H,4,9-12H2,1H3,(H,23,26)(H,24,28)
InChIKey
IWIPNYZRVVJIDF-UHFFFAOYSA-N
Synonyms

132286386
InChI=1SC22H23N3O5Sc13112917(2521(27)15523616(15)2422(25)28)20(26)2314781819(1314)30114102918h23581317H4912H21H3(H2326)(H2428)
MFCD32652742
N(34dihydro2H15benzodioxepin7yl)2(24dioxo1Hquinazolin3yl)4methylsulfanylbutanamide
N(34dihydro2H15benzodioxepin7yl)2(2hydroxy4oxoquinazolin3(4H)yl)4(methylsulfanyl)butanamide
ZINC000524733711
ZINC000888090203

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Available files

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