Vitas-M small molecule compound
3-(4-bromobenzyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STK831811
SMILES Brc1ccc(cc1)Cn1cnc2c(c1=O)sc1c2cc2c(n1)CC(OC2)(C)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 C21H18BrN3O2S MW 456.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN3O2S/c1-21(2)8-16-13(10-27-21)7-15-17-18(28-19(15)24-16)20(26)25(11-23-17)9-12-3-5-14(22)6-4-12/h3-7,11H,8-10H2,1-2H3InChIKey
AWVZCKPQXHEOAU-UHFFFAOYSA-NSynonyms
831179-46-53(4bromobenzyl)88dimethyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(3H)one
3(4bromobenzyl)88dimethyl78dihydro3Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(10H)one
831179465
CC1(CC2=C(CO1)C=C3C4=C(C(=O)N(C=N4)CC5=CC=C(C=C5)Br)SC3=N2)C
InChI=1SC21H18BrN3O2Sc121(2)81613(102721)7151718(2819(15)2416)20(26)25(112317)9123514(22)6412h3711H810H212H3
MFCD04017249
ZINC000009459738
ZINC09459738
ZINC9459738
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