Vitas-M small molecule compound
11-chloro-3-(3,4-dimethoxyphenyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Catalog ID
STK589224
SMILES COc1cc(ccc1OC)N1COc2c(C1)c1oc(=O)c3c(c1cc2Cl)CCC3
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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 C22H20ClNO5 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO5/c1-26-18-7-6-12(8-19(18)27-2)24-10-16-20-15(9-17(23)21(16)28-11-24)13-4-3-5-14(13)22(25)29-20/h6-9H,3-5,10-11H2,1-2H3InChIKey
JNJFBTYIDHRZQX-UHFFFAOYSA-NSynonyms
877806-82-111chloro3(34dimethoxyphenyl)3489tetrahydro2Hcyclopenta(34)chromeno(87e)(13)oxazin6(7H)one
877806821
COC1=C(C=C(C=C1)N2CC3=C4C(=CC(=C3OC2)Cl)C5=C(CCC5)C(=O)O4)OC
InChI=1SC22H20ClNO5c126187612(819(18)272)2410162015(917(23)21(16)281124)1343514(13)22(25)2920h69H351011H212H3
MFCD05705508
ZINC000005516522
ZINC05516522
ZINC5516522
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