Vitas-M small molecule compound
2-(7-methyl-4-oxo-1,2,3,4,5,6,7,8-octahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl 3,4,5-trimethoxybenzoate
Catalog ID
STL259762
SMILES COc1cc(cc(c1OC)OC)C(=O)Oc1ccccc1C1NC(=O)c2c(N1)sc1c2CCN(C1)C
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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 C26H27N3O6S MW 509.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6S/c1-29-10-9-16-20(13-29)36-25-21(16)24(30)27-23(28-25)15-7-5-6-8-17(15)35-26(31)14-11-18(32-2)22(34-4)19(12-14)33-3/h5-8,11-12,23,28H,9-10,13H2,1-4H3,(H,27,30)InChIKey
AGZWXKCZGTYQMY-UHFFFAOYSA-NSynonyms
336169-58-5(2(7methyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)345trimethoxybenzoate
2(7methyl4oxo12345678octahydropyrido(4345)thieno(23d)pyrimidin2yl)phenyl345trimethoxybenzoate
336169585
CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=CC=C4OC(=O)C5=CC(=C(C(=C5)OC)OC)OC
InChI=1SC26H27N3O6Sc1291091620(1329)362521(16)24(30)2723(2825)15756817(15)3526(31)141118(322)22(344)19(1214)333h5811122328H91013H214H3(H2730)
MFCD01817264
ZINC000002297073
ZINC000009379811
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