Vitas-M small molecule compound

4-{[4-(ethylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]carbonyl}-3,4-dihydroquinoxalin-2(1H)-one

Catalog ID
STL286465
SMILES CCS(=O)(=O)N1CC(Oc2c1cccc2)C(=O)N1CC(=O)Nc2c1cccc2

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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 C19H19N3O5S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S/c1-2-28(25,26)22-11-17(27-16-10-6-5-9-15(16)22)19(24)21-12-18(23)20-13-7-3-4-8-14(13)21/h3-10,17H,2,11-12H2,1H3,(H,20,23)
InChIKey
AYVWLQBCKZJGQN-UHFFFAOYSA-N
Synonyms

4((4(ethylsulfonyl)34dihydro2H14benzoxazin2yl)carbonyl)34dihydroquinoxalin2(1H)one
4(4ethylsulfonyl23dihydro14benzoxazine2carbonyl)13dihydroquinoxalin2one
CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)N3CC(=O)NC4=CC=CC=C43
InChI=1SC19H19N3O5Sc1228(2526)221117(27161065915(16)22)19(24)211218(23)2013734814(13)21h31017H21112H21H3(H2023)
MFCD24850307
ZINC000026112810
ZINC000026112816

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Available files

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