Vitas-M small molecule compound
3-[2-(4-bromophenyl)-2-oxoethyl]-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
STK531608
SMILES Brc1ccc(cc1)C(=O)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 C22H18BrN3O3S MW 484.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3O3S/c1-22(2)8-16-13(10-29-22)7-15-18-19(30-20(15)25-16)21(28)26(11-24-18)9-17(27)12-3-5-14(23)6-4-12/h3-7,11H,8-10H2,1-2H3InChIKey
CAFXVVAKGYWSBY-UHFFFAOYSA-NSynonyms
3(2(4bromophenyl)2oxoethyl)88dimethyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(3H)one
3(2(4bromophenyl)2oxoethyl)88dimethyl78dihydro3Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(10H)one
CC1(CC2=C(CO1)C=C3C4=C(C(=O)N(C=N4)CC(=O)C5=CC=C(C=C5)Br)SC3=N2)C
InChI=1SC22H18BrN3O3Sc122(2)81613(102922)7151819(3020(15)2516)21(28)26(112418)917(27)123514(23)6412h3711H810H212H3
MFCD02992246
ZINC000009353359
ZINC09353359
ZINC9353359
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