Vitas-M small molecule compound
(2E)-N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK729870
SMILES COc1ccc(cc1Cl)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 C23H18ClN5O4 MW 463.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN5O4/c1-14-10-20-21(27-28(26-20)16-7-8-22(33-2)18(24)12-16)13-19(14)25-23(30)9-6-15-4-3-5-17(11-15)29(31)32/h3-13H,1-2H3,(H,25,30)/b9-6+InChIKey
CRPIUQRLDOZTLD-RMKNXTFCSA-NSynonyms
488802-87-5(2E)N(2(3chloro4methoxyphenyl)6methyl2Hbenzotriazol5yl)3(3nitrophenyl)prop2enamide
(E)N(2(3chloro4methoxyphenyl)6methyl2Hbenzo(d)(123)triazol5yl)3(3nitrophenyl)acrylamide
(E)N(2(3CHLORO4METHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)3(3NITROPHENYL)PROP2ENAMIDE
488802875
CC1=CC2=NN(N=C2C=C1NC(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O))C4=CC(=C(C=C4)OC)Cl
COc1ccc(cc1Cl)n1nc2c(n1)cc(c(c2)C)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC23H18ClN5O4c114102021(2728(2620)167822(332)18(24)1216)1319(14)2523(30)961543517(1115)29(31)32h313H12H3(H2530)b96+
MFCD03293145
ZINC000002284260
ZINC02284260
ZINC2284260
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