Vitas-M small molecule compound
9-(2-chlorobenzyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Catalog ID
STK624356
SMILES Clc1ccccc1Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)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 C22H20ClN3O2S MW 425.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O2S/c1-12-15-10-28-22(2,3)8-14(15)17-18-19(29-20(17)25-12)21(27)26(11-24-18)9-13-6-4-5-7-16(13)23/h4-7,11H,8-10H2,1-3H3InChIKey
HKLPRBBYSYYPPK-UHFFFAOYSA-NSynonyms
929851-77-49(2chlorobenzyl)225trimethyl14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8(9H)one
9(2chlorobenzyl)225trimethyl49dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8(2H)one
929851774
CC1=C2COC(CC2=C3C4=C(C(=O)N(C=N4)CC5=CC=CC=C5Cl)SC3=N1)(C)C
InChI=1SC22H20ClN3O2Sc11215102822(23)814(15)171819(2920(17)2512)21(27)26(112418)913645716(13)23h4711H810H213H3
MFCD09790102
ZINC000009422260
ZINC09422260
ZINC9422260
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