Vitas-M small molecule compound
9-(2-chloro-6-fluorobenzyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Catalog ID
STK579157
SMILES Fc1cccc(c1CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2)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 C22H19ClFNO3 MW 399.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClFNO3/c1-12-20-13(8-16-14-4-2-5-15(14)22(26)28-21(12)16)9-25(11-27-20)10-17-18(23)6-3-7-19(17)24/h3,6-8H,2,4-5,9-11H2,1H3InChIKey
MRBCGHJIDCGWPO-UHFFFAOYSA-NSynonyms
862193-64-4862193644
9(2chloro6fluorobenzyl)6methyl23910tetrahydro1Hcyclopenta(34)chromeno(67e)(13)oxazin4(8H)one
9(2chloro6fluorobenzyl)6methyl23910tetrahydro8Hcyclopenta(34)chromeno(67e)(13)oxazin4(1H)one
CC1=C2C(=CC3=C1OCN(C3)CC4=C(C=CC=C4Cl)F)C5=C(CCC5)C(=O)O2
InChI=1SC22H19ClFNO3c1122013(8161442515(14)22(26)2821(12)16)925(112720)101718(23)63719(17)24h368H245911H21H3
MFCD05696576
ZINC000057105484
ZINC57105484
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