Vitas-M small molecule compound
ethyl 2-amino-5'-bromo-7-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Catalog ID
STK210213
SMILES CCOC(=O)C1=C(N)OC2=C(C31C(=O)Nc1c3cc(Br)cc1)C(=O)CC(C2)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 C20H19BrN2O5 MW 447.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN2O5/c1-3-27-18(25)16-17(22)28-14-7-9(2)6-13(24)15(14)20(16)11-8-10(21)4-5-12(11)23-19(20)26/h4-5,8-9H,3,6-7,22H2,1-2H3,(H,23,26)InChIKey
NNJHQYBRBYFPIO-UHFFFAOYSA-NSynonyms
726201-22-5726201225
CCOC(=O)C1=C(OC2=C(C13C4=C(C=CC(=C4)Br)NC3=O)C(=O)CC(C2)C)N
ethyl2amino5bromo7methyl25dioxo125678hexahydrospiro(chromene43indole)3carboxylate
ethyl2amino5bromo7methyl25dioxo5678tetrahydrospiro(chromene43indoline)3carboxylate
ethyl2amino5bromo7methyl25dioxospiro(1Hindole3478dihydro6Hchromene)3carboxylate
InChI=1SC20H19BrN2O5c132718(25)1617(22)281479(2)613(24)15(14)20(16)11810(21)4512(11)2319(20)26h4589H36722H212H3(H2326)
MFCD06016322
ZINC000002443745
ZINC000010035325
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