Vitas-M small molecule compound
N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3-nitrobenzamide
Catalog ID
STK078131
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)Nc1ccc2c(c1)nc(o2)c1ccccc1Br
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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 C21H14BrN3O4 MW 452.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrN3O4/c1-12-6-7-13(10-18(12)25(27)28)20(26)23-14-8-9-19-17(11-14)24-21(29-19)15-4-2-3-5-16(15)22/h2-11H,1H3,(H,23,26)InChIKey
WDEJJGLHWXRFGU-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4Br)(N+)(=O)(O)
InChI=1SC21H14BrN3O4c1126713(1018(12)25(27)28)20(26)2314891917(1114)2421(2919)15423516(15)22h211H1H3(H2326)
MFCD00702317
N(2(2BROMOPHENYL)13BENZOXAZOL5YL)3NITRO4METHYLBENZAMIDE
N(2(2BROMOPHENYL)13BENZOXAZOL5YL)4METHYL3NITROBENZAMIDE
N(2(2BROMOPHENYL)BENZOOXAZOL5YL)4METHYL3NITROBENZAMIDE
N(2(2BROMOPHENYL)BENZOXAZOL5YL)(4METHYL3NITROPHENYL)CARBOXAMIDE
O=C(c1ccc(c(c1)(N+)(=O)(O))C)Nc1ccc2c(c1)nc(o2)c1ccccc1Br
STK078131
ZINC000000677003
ZINC00677003
ZINC677003
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