Vitas-M small molecule compound
2-bromo-6-methoxy-4-(2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)phenyl acetate
Catalog ID
STK336145
SMILES COc1cc(cc(c1OC(=O)C)Br)C1C2=C(Nc3c1c(=O)[nH]c(=O)[nH]3)c1c(C2=O)cccc1
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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 C23H16BrN3O6 MW 510.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrN3O6/c1-9(28)33-20-13(24)7-10(8-14(20)32-2)15-16-18(11-5-3-4-6-12(11)19(16)29)25-21-17(15)22(30)27-23(31)26-21/h3-8,15H,1-2H3,(H3,25,26,27,30,31)InChIKey
JFNIGEPJRJEDKV-UHFFFAOYSA-NSynonyms
2bromo6methoxy4(246trioxo2345611hexahydro1Hindeno(2156)pyrido(23d)pyrimidin5yl)phenylacetate
CC(=O)OC1=C(C=C(C=C1Br)C2C3=C(C4=CC=CC=C4C3=O)NC5=C2C(=O)NC(=O)N5)OC
COc1cc(cc(c1OC(=O)C)Br)C1C2=C(Nc3c1c(=O)(nH)c(=O)(nH)3)c1c(C2=O)cccc1
InChI=1SC23H16BrN3O6c19(28)332013(24)710(814(20)322)151618(11534612(11)19(16)29)252117(15)22(30)2723(31)2621h3815H12H3(H32526273031)
MFCD09964527
ZINC000018201149
ZINC000018201150
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