Vitas-M small molecule compound
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-3-hydroxy-2H-1,4-benzoxazine-6-carboxamide
Catalog ID
STL566718
SMILES CC[C@@H]([C@@H](c1nc2c([nH]1)cccc2)NC(=O)c1ccc2c(c1)N=C(CO2)O)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 C21H22N4O3 MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3/c1-3-12(2)19(20-23-14-6-4-5-7-15(14)24-20)25-21(27)13-8-9-17-16(10-13)22-18(26)11-28-17/h4-10,12,19H,3,11H2,1-2H3,(H,22,26)(H,23,24)(H,25,27)/t12-,19-/m0/s1InChIKey
QZLGQKSTRVGQFD-BUXKBTBVSA-NSynonyms
91640008
InChI=1SC21H22N4O3c1312(2)19(202314645715(14)2420)2521(27)13891716(1013)2218(26)112817h4101219H311H212H3(H2226)(H2324)(H2527)t1219m0s1
MFCD32652160
N((1S)1(1Hbenzimidazol2yl)2methylbutyl)3hydroxy2H14benzoxazine6carboxamide
N((1S2S)1(1Hbenzimidazol2yl)2methylbutyl)3oxo4H14benzoxazine6carboxamide
ZINC000055441532
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