Vitas-M small molecule compound
4-methyl-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]-3-nitrobenzamide
Catalog ID
STK427034
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)Nc1ccc(c2c1non2)N1CCOCC1
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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 C18H17N5O5 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O5/c1-11-2-3-12(10-15(11)23(25)26)18(24)19-13-4-5-14(17-16(13)20-28-21-17)22-6-8-27-9-7-22/h2-5,10H,6-9H2,1H3,(H,19,24)InChIKey
AOXOMMKJWQWMIQ-UHFFFAOYSA-NSynonyms
(4METHYL3NITROPHENYL)N(7MORPHOLIN4YLBENZO(23C)125OXADIAZOL4YL)CARBOXAMIDE
4METHYLN(4MORPHOLIN4YL213BENZOXADIAZOL7YL)3NITROBENZAMIDE
4methylN(7(morpholin4yl)213benzoxadiazol4yl)3nitrobenzamide
CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C3=NON=C23)N4CCOCC4)(N+)(=O)(O)
InChI=1SC18H17N5O5c1112312(1015(11)23(25)26)18(24)19134514(1716(13)20282117)2268279722h2510H69H21H3(H1924)
MFCD02612426
O=C(c1ccc(c(c1)(N+)(=O)(O))C)Nc1ccc(c2c1non2)N1CCOCC1
ZINC000002805945
ZINC02805945
ZINC2805945
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