Vitas-M small molecule compound
9-(1,3-benzodioxol-5-ylmethyl)-3-benzyl-6-chloro-4-methyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Catalog ID
STL226233
SMILES Clc1cc2c(c3c1OCN(C3)Cc1ccc3c(c1)OCO3)oc(=O)c(c2C)Cc1ccccc1
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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 C27H22ClNO5 MW 475.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClNO5/c1-16-19-11-22(28)26-21(25(19)34-27(30)20(16)9-17-5-3-2-4-6-17)13-29(14-31-26)12-18-7-8-23-24(10-18)33-15-32-23/h2-8,10-11H,9,12-15H2,1H3InChIKey
GCUHMZMSOOBFBY-UHFFFAOYSA-NSynonyms
848869-07-8848869078
9(13BENZODIOXOL5YLMETHYL)3BENZYL6CHLORO4METHYL810DIHYDROPYRANO(23F)(13)BENZOXAZIN2ONE
9(13benzodioxol5ylmethyl)3benzyl6chloro4methyl910dihydro2H8Hchromeno(87e)(13)oxazin2one
9(benzo(d)(13)dioxol5ylmethyl)3benzyl6chloro4methyl910dihydrochromeno(87e)(13)oxazin2(8H)one
CC1=C(C(=O)OC2=C3CN(COC3=C(C=C12)Cl)CC4=CC5=C(C=C4)OCO5)CC6=CC=CC=C6
InChI=1SC27H22ClNO5c116191122(28)2621(25(19)3427(30)20(16)9175324617)1329(143126)1218782324(1018)33153223h281011H91215H21H3
MFCD04197445
ZINC000020403814
ZINC20403814
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