Vitas-M small molecule compound
(4Z)-4-[(1-acetyl-1H-indol-3-yl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STL049645
SMILES O=C1OC(=N/C/1=C\c1cn(c2c1cccc2)C(=O)C)c1ccc(cc1)[N+](=O)[O-]
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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 C20H13N3O5 MW 375.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O5/c1-12(24)22-11-14(16-4-2-3-5-18(16)22)10-17-20(25)28-19(21-17)13-6-8-15(9-7-13)23(26)27/h2-11H,1H3/b17-10-InChIKey
KPYYXVSIJVCYGO-YVLHZVERSA-NSynonyms
357154-77-9(4Z)4((1acetyl1Hindol3yl)methylidene)2(4nitrophenyl)13oxazol5(4H)one
(4Z)4((1ACETYLINDOL3YL)METHYLIDENE)2(4NITROPHENYL)13OXAZOL5ONE
(Z)4((1acetyl1Hindol3yl)methylene)2(4nitrophenyl)oxazol5(4H)one
357154779
CC(=O)N1C=C(C2=CC=CC=C21)C=C3C(=O)OC(=N3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC20H13N3O5c112(24)221114(16423518(16)22)101720(25)2819(2117)136815(9713)23(26)27h211H1H3b1710
MFCD02992117
O=C1OC(=NC1=Cc1cn(c2c1cccc2)C(=O)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000001735879
ZINC01735879
ZINC1735879
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