Vitas-M small molecule compound
12-chloro-3-[2-(3,4-dimethoxyphenyl)ethyl]-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STK829503
SMILES COc1cc(CCN2COc3c(C2)c2oc(=O)c4c(c2cc3Cl)CCCC4)ccc1OC
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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 C25H26ClNO5 MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClNO5/c1-29-21-8-7-15(11-22(21)30-2)9-10-27-13-19-23-18(12-20(26)24(19)31-14-27)16-5-3-4-6-17(16)25(28)32-23/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3InChIKey
NNSNYJFDQBIAGU-UHFFFAOYSA-NSynonyms
850732-01-312chloro3(2(34dimethoxyphenyl)ethyl)2478910hexahydroisochromeno(34f)(13)benzoxazin6one
12chloro3(2(34dimethoxyphenyl)ethyl)3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
12chloro3(34dimethoxyphenethyl)3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
850732013
COC1=C(C=C(C=C1)CCN2CC3=C4C(=CC(=C3OC2)Cl)C5=C(CCCC5)C(=O)O4)OC
InChI=1SC25H26ClNO5c129218715(1122(21)302)9102713192318(1220(26)24(19)311427)16534617(16)25(28)3223h781112H369101314H212H3
MFCD05693117
ZINC000020412249
ZINC20412249
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