Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-4-(methylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide

Catalog ID
STL389831
SMILES Cc1ccc2c(c1)N(CC(O2)C(=O)NCc1ccc2c(c1)OCO2)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 C19H20N2O6S MW 404.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O6S/c1-12-3-5-15-14(7-12)21(28(2,23)24)10-18(27-15)19(22)20-9-13-4-6-16-17(8-13)26-11-25-16/h3-8,18H,9-11H2,1-2H3,(H,20,22)
InChIKey
GMGMVIJVJCYSIZ-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)OC(CN2S(=O)(=O)C)C(=O)NCC3=CC4=C(C=C3)OCO4
InChI=1SC19H20N2O6Sc112351514(712)21(28(223)24)1018(2715)19(22)20913461617(813)26112516h3818H911H212H3(H2022)
MFCD13988099
N(13benzodioxol5ylmethyl)6methyl4(methylsulfonyl)34dihydro2H14benzoxazine2carboxamide
N(13benzodioxol5ylmethyl)6methyl4methylsulfonyl23dihydro14benzoxazine2carboxamide
ZINC000038858806
ZINC000038858808

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Available files

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