Vitas-M small molecule compound

N-{2-[4-(methylsulfonyl)piperazin-1-yl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide

Catalog ID
STK279021
SMILES O=C(CN1C(=O)COc2c1cccc2)Nc1ccccc1N1CCN(CC1)S(=O)(=O)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 C21H24N4O5S MW 444.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O5S/c1-31(28,29)24-12-10-23(11-13-24)17-7-3-2-6-16(17)22-20(26)14-25-18-8-4-5-9-19(18)30-15-21(25)27/h2-9H,10-15H2,1H3,(H,22,26)
InChIKey
MCXGQIFIJOKPMM-UHFFFAOYSA-N
Synonyms

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)CN3C(=O)COC4=CC=CC=C43
InChI=1SC21H24N4O5Sc131(2829)24121023(111324)17732616(17)2220(26)142518845919(18)301521(25)27h29H1015H21H3(H2226)
MFCD09269678
N(2(4(methylsulfonyl)piperazin1yl)phenyl)2(3oxo23dihydro4H14benzoxazin4yl)acetamide
N(2(4methylsulfonylpiperazin1yl)phenyl)2(3oxo14benzoxazin4yl)acetamide
ZINC000009096069
ZINC09096069
ZINC9096069

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.