Vitas-M small molecule compound
(2E)-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK003423
SMILES COc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=O)/C=C/c1cccc(c1)[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 C23H19N5O4 MW 429.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O4/c1-15-12-21-22(26-27(25-21)17-7-9-19(32-2)10-8-17)14-20(15)24-23(29)11-6-16-4-3-5-18(13-16)28(30)31/h3-14H,1-2H3,(H,24,29)/b11-6+InChIKey
AJAJBXSIUGKZFS-IZZDOVSWSA-NSynonyms
(2E)N(2(4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(2(4METHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)3(3NITROPHENYL)PROP2ENAMIDE
CC1=CC2=NN(N=C2C=C1NC(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O))C4=CC=C(C=C4)OC
COc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC23H19N5O4c115122122(2627(2521)177919(322)10817)1420(15)2423(29)1161643518(1316)28(30)31h314H12H3(H2429)b116+
MFCD02220425
STK003423
ZINC000001176278
ZINC01176278
ZINC1176278
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