Vitas-M small molecule compound
N-[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
Catalog ID
STK015278
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1cccc(c1C)c1oc2c(n1)cc(c(c2)C)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 C25H23N3O5 MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5/c1-5-32-22-10-9-17(13-21(22)28(30)31)24(29)26-19-8-6-7-18(16(19)4)25-27-20-11-14(2)15(3)12-23(20)33-25/h6-13H,5H2,1-4H3,(H,26,29)InChIKey
IUPFVTJLPICJIT-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2C)C3=NC4=C(O3)C=C(C(=C4)C)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1cccc(c1C)c1oc2c(n1)cc(c(c2)C)C
InChI=1SC25H23N3O5c15322210917(1321(22)28(30)31)24(29)261986718(16(19)4)2527201114(2)15(3)1223(20)3325h613H5H214H3(H2629)
MFCD02630730
N(3(56DIMETHYL13BENZOXAZOL2YL)2METHYLPHENYL)4ETHOXY3NITROBENZAMIDE
STK015278
ZINC000001174408
ZINC01174408
ZINC1174408
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