Vitas-M small molecule compound

methyl [9-(1-benzylpiperidin-4-yl)-6-chloro-4-methyl-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]acetate

Catalog ID
STK616752
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c1c2CN(CO1)C1CCN(CC1)Cc1ccccc1)Cl

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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 C27H29ClN2O5 MW 496.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29ClN2O5/c1-17-20-12-23(28)26-22(25(20)35-27(32)21(17)13-24(31)33-2)15-30(16-34-26)19-8-10-29(11-9-19)14-18-6-4-3-5-7-18/h3-7,12,19H,8-11,13-16H2,1-2H3
InChIKey
RZIXTRNBVUVUOP-UHFFFAOYSA-N
Synonyms
903186-10-7
903186107
CC1=C(C(=O)OC2=C3CN(COC3=C(C=C12)Cl)C4CCN(CC4)CC5=CC=CC=C5)CC(=O)OC
InChI=1SC27H29ClN2O5c117201223(28)2622(25(20)3527(32)21(17)1324(31)332)1530(163426)1981029(11919)14186435718h371219H8111316H212H3
methyl(9(1benzylpiperidin4yl)6chloro4methyl2oxo910dihydro2H8Hchromeno(87e)(13)oxazin3yl)acetate
methyl2(9(1benzylpiperidin4yl)6chloro4methyl2oxo28910tetrahydrochromeno(87e)(13)oxazin3yl)acetate
methyl2(9(1benzylpiperidin4yl)6chloro4methyl2oxo810dihydropyrano(23f)(13)benzoxazin3yl)acetate
MFCD08290249
ZINC000009410486
ZINC9410486

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Available files

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