Vitas-M small molecule compound
2-methyl-N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
Catalog ID
STK045467
SMILES Cc1cccc(c1)c1oc2c(n1)cc(cc2)NC(=O)c1cccc(c1C)[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 C22H17N3O4 MW 387.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4/c1-13-5-3-6-15(11-13)22-24-18-12-16(9-10-20(18)29-22)23-21(26)17-7-4-8-19(14(17)2)25(27)28/h3-12H,1-2H3,(H,23,26)InChIKey
BUPDKZHVZGILSM-UHFFFAOYSA-NSynonyms
2METHYLN(2(3METHYLPHENYL)13BENZOXAZOL5YL)3NITROBENZAMIDE
CC1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C(=CC=C4)(N+)(=O)(O))C
Cc1cccc(c1)c1oc2c(n1)cc(cc2)NC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC22H17N3O4c11353615(1113)2224181216(91020(18)2922)2321(26)1774819(14(17)2)25(27)28h312H12H3(H2326)
MFCD02639863
STK045467
ZINC000002979091
ZINC02979091
ZINC2979091
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