Vitas-M small molecule compound
4-[(4-methoxyphenyl)sulfonyl]-7-methyl-N-[2-(propan-2-yl)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385731
SMILES COc1ccc(cc1)S(=O)(=O)N1CC(Oc2c1ccc(c2)C)C(=O)Nc1ccccc1C(C)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 C26H28N2O5S MW 480.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O5S/c1-17(2)21-7-5-6-8-22(21)27-26(29)25-16-28(23-14-9-18(3)15-24(23)33-25)34(30,31)20-12-10-19(32-4)11-13-20/h5-15,17,25H,16H2,1-4H3,(H,27,29)InChIKey
DMSBRDPKBICJHO-UHFFFAOYSA-NSynonyms
4((4methoxyphenyl)sulfonyl)7methylN(2(propan2yl)phenyl)34dihydro2H14benzoxazine2carboxamide
4(4methoxyphenyl)sulfonyl7methylN(2propan2ylphenyl)23dihydro14benzoxazine2carboxamide
CC1=CC2=C(C=C1)N(CC(O2)C(=O)NC3=CC=CC=C3C(C)C)S(=O)(=O)C4=CC=C(C=C4)OC
InChI=1SC26H28N2O5Sc117(2)21756822(21)2726(29)251628(2314918(3)1524(23)3325)34(3031)20121019(324)111320h5151725H16H214H3(H2729)
MFCD27217763
ZINC000064986428
ZINC000064986429
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