Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-6-tert-butyl-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385371
SMILES O=C(C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccccc1)C(C)(C)C)Nc1ccc2c(c1)OCO2
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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 C26H26N2O6S MW 494.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O6S/c1-26(2,3)17-9-11-21-20(13-17)28(35(30,31)19-7-5-4-6-8-19)15-24(34-21)25(29)27-18-10-12-22-23(14-18)33-16-32-22/h4-14,24H,15-16H2,1-3H3,(H,27,29)InChIKey
FFSPOMPWJCYMDL-UHFFFAOYSA-NSynonyms
4(benzenesulfonyl)N(13benzodioxol5yl)6tertbutyl23dihydro14benzoxazine2carboxamide
CC(C)(C)C1=CC2=C(C=C1)OC(CN2S(=O)(=O)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5
InChI=1SC26H26N2O6Sc126(23)179112120(1317)28(35(3031)197546819)1524(3421)25(29)271810122223(1418)33163222h41424H1516H213H3(H2729)
MFCD27217398
N(13benzodioxol5yl)6tertbutyl4(phenylsulfonyl)34dihydro2H14benzoxazine2carboxamide
ZINC000064985567
ZINC000064985569
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