Vitas-M small molecule compound
3'-butyl 5'-ethyl 2'-amino-5-bromo-6'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate
Catalog ID
STL015980
SMILES CCCCOC(=O)C1=C(N)OC(=C(C21C(=O)Nc1c2cc(Br)cc1)C(=O)OCC)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 C21H23BrN2O6 MW 479.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN2O6/c1-4-6-9-29-19(26)16-17(23)30-11(3)15(18(25)28-5-2)21(16)13-10-12(22)7-8-14(13)24-20(21)27/h7-8,10H,4-6,9,23H2,1-3H3,(H,24,27)InChIKey
XOUOULFZRQBGFE-UHFFFAOYSA-NSynonyms
(S)3butyl5ethyl2amino5bromo6methyl2oxospiro(indoline34pyran)35dicarboxylate
3BUTYL5ETHYL2AMINO5BROMO6METHYL12DIHYDRO2OXOSPIRO(INDOLE34PYRAN)35DICARBOXYLATE
3butyl5ethyl2amino5bromo6methyl2oxo12dihydrospiro(indole34pyran)35dicarboxylate
3OBUTYL5OETHYL2AMINO5BROMO6METHYL2OXOSPIRO(1HINDOLE34PYRAN)35DICARBOXYLATE
CCCCOC(=O)C1=C(N)OC(=C((C@@)21C(=O)Nc1c2cc(Br)cc1)C(=O)OCC)C
CCCCOC(=O)C1=C(OC(=C(C12C3=C(C=CC(=C3)Br)NC2=O)C(=O)OCC)C)N
InChI=1SC21H23BrN2O6c14692919(26)1617(23)3011(3)15(18(25)2852)21(16)131012(22)7814(13)2420(21)27h7810H46923H213H3(H2427)
MFCD18186905
ZINC000002213745
ZINC000009076259
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