Vitas-M small molecule compound
2,2-dimethyl-10-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethoxy}-3,4,8,9-tetrahydro-2H-cyclopenta[c]pyrano[2,3-h]chromen-6(7H)-one
Catalog ID
STK634396
SMILES O=C(N1CCN(CC1)c1ccccn1)COc1cc2OC(C)(C)CCc2c2c1c1CCCc1c(=O)o2
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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 C28H31N3O5 MW 489.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O5/c1-28(2)10-9-20-21(36-28)16-22(25-18-6-5-7-19(18)27(33)35-26(20)25)34-17-24(32)31-14-12-30(13-15-31)23-8-3-4-11-29-23/h3-4,8,11,16H,5-7,9-10,12-15,17H2,1-2H3InChIKey
OOVSJLQNCKOWJN-UHFFFAOYSA-NSynonyms
1014404-10-41014404104
22dimethyl10(2oxo2(4(pyridin2yl)piperazin1yl)ethoxy)3489tetrahydro2Hcyclopenta(c)pyrano(23h)chromen6(7H)one
CC1(CCC2=C3C(=C(C=C2O1)OCC(=O)N4CCN(CC4)C5=CC=CC=N5)C6=C(CCC6)C(=O)O3)C
InChI=1SC28H31N3O5c128(2)1092021(3628)1622(251865719(18)27(33)3526(20)25)341724(32)31141230(131531)23834112923h3481116H57910121517H212H3
ZINC000009341751
ZINC9341751
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