Vitas-M small molecule compound
butyl 2'-amino-5-bromo-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate
Catalog ID
STL005188
SMILES CCCCOC(=O)C1=C(N)Oc2c(C31C(=O)Nc1c3cc(Br)cc1)c(=O)oc1c2cccc1
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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 C24H19BrN2O6 MW 511.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN2O6/c1-2-3-10-31-21(28)18-20(26)33-19-13-6-4-5-7-16(13)32-22(29)17(19)24(18)14-11-12(25)8-9-15(14)27-23(24)30/h4-9,11H,2-3,10,26H2,1H3,(H,27,30)InChIKey
SJOSPUGHBDVESX-UHFFFAOYSA-NSynonyms
(S)butyl2amino5bromo25dioxo5Hspiro(indoline34pyrano(32c)chromene)3carboxylate
butyl2amino5bromo25dioxo12dihydro5Hspiro(indole34pyrano(32c)chromene)3carboxylate
BUTYL2AMINO5BROMO25DIOXOSPIRO(1HINDOLE34PYRANO(32C)CHROMENE)3CARBOXYLATE
CCCCOC(=O)C1=C(N)Oc2c((C@@)31C(=O)Nc1c3cc(Br)cc1)c(=O)oc1c2cccc1
CCCCOC(=O)C1=C(OC2=C(C13C4=C(C=CC(=C4)Br)NC3=O)C(=O)OC5=CC=CC=C52)N
InChI=1SC24H19BrN2O6c123103121(28)1820(26)331913645716(13)3222(29)17(19)24(18)141112(25)8915(14)2723(24)30h4911H231026H21H3(H2730)
MFCD07085303
ZINC000009292346
ZINC000016007253
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