Vitas-M small molecule compound
3-(4-bromo-3-methylphenyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STK716702
SMILES Brc1ccc(cc1C)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3
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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 C22H20BrNO3 MW 426.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO3/c1-13-10-14(6-8-19(13)23)24-11-18-20(26-12-24)9-7-16-15-4-2-3-5-17(15)22(25)27-21(16)18/h6-10H,2-5,11-12H2,1H3InChIKey
RMIZAIGBAILBNX-UHFFFAOYSA-NSynonyms
850720-81-93(4bromo3methylphenyl)2478910hexahydroisochromeno(34f)(13)benzoxazin6one
3(4bromo3methylphenyl)3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
3(4bromo3methylphenyl)3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
850720819
CC1=C(C=CC(=C1)N2CC3=C(C=CC4=C3OC(=O)C5=C4CCCC5)OC2)Br
InChI=1SC22H20BrNO3c1131014(6819(13)23)24111820(261224)971615423517(15)22(25)2721(16)18h610H251112H21H3
MFCD05692535
ZINC000002395232
ZINC02395232
ZINC2395232
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