Vitas-M small molecule compound
ethyl 4-({[(3R,3'S,5'S)-5'-(3-amino-3-oxopropyl)-5-bromo-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidin]-3'-yl]carbonyl}amino)benzoate
Catalog ID
STL535341
SMILES CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Br)cc1)CCC(=O)N
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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 C24H25BrN4O5 MW 529.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25BrN4O5/c1-2-34-22(32)13-3-6-15(7-4-13)27-21(31)18-12-16(8-10-20(26)30)29-24(18)17-11-14(25)5-9-19(17)28-23(24)33/h3-7,9,11,16,18,29H,2,8,10,12H2,1H3,(H2,26,30)(H,27,31)(H,28,33)/t16-,18+,24-/m0/s1InChIKey
CNSWEPNDOGXXBU-GXYVPTEVSA-NSynonyms
1014059-45-01014059450
17572124
CCOC(=O)c1ccc(cc1)NC(=O)(C@H)1C(C@@H)(N(C@@)21C(=O)Nc1c2cc(Br)cc1)CCC(=O)N
ethyl4((((3R3S5S)5(3amino3oxopropyl)5bromo2oxo12dihydrospiro(indole32pyrrolidin)3yl)carbonyl)amino)benzoate
ethyl4(((3~(R)3~(S)5~(S))5(3amino3oxopropyl)5bromo2oxospiro(1~(H)indole32pyrrolidine)3carbonyl)amino)benzoate
ethyl4((2R3S5S)5(3amino3oxopropyl)5bromo2oxospiro(indoline32pyrrolidin)3ylcarboxamido)benzoate
InChI=1SC24H25BrN4O5c123422(32)133615(7413)2721(31)181216(81020(26)30)2924(18)171114(25)5919(17)2823(24)33h37911161829H281012H21H3(H22630)(H2731)(H2833)t1618+24m0s1
MFCD09843802
ZINC000070712267
ZINC70712267
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