Vitas-M small molecule compound

(2E)-3-(5-bromo-2-methoxyphenyl)-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)prop-2-enamide

Catalog ID
STK083932
SMILES COc1ccc(cc1/C=C/C(=O)Nc1cc2nn(nc2cc1C)c1ccccc1)Br

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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 C23H19BrN4O2 MW 463.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN4O2/c1-15-12-20-21(27-28(26-20)18-6-4-3-5-7-18)14-19(15)25-23(29)11-8-16-13-17(24)9-10-22(16)30-2/h3-14H,1-2H3,(H,25,29)/b11-8+
InChIKey
PWJJPLSGNXAVBZ-DHZHZOJOSA-N
Synonyms
364602-27-7
(2E)3(5BROMO2METHOXYPHENYL)N(6METHYL2PHENYL2HBENZOTRIAZOL5YL)PROP2ENAMIDE
(E)3(5bromo2methoxyphenyl)N(6methyl2phenyl2Hbenzo(d)(123)triazol5yl)acrylamide
(E)3(5BROMO2METHOXYPHENYL)N(6METHYL2PHENYLBENZOTRIAZOL5YL)PROP2ENAMIDE
364602277
CC1=CC2=NN(N=C2C=C1NC(=O)C=CC3=C(C=CC(=C3)Br)OC)C4=CC=CC=C4
COc1ccc(cc1C=CC(=O)Nc1cc2nn(nc2cc1C)c1ccccc1)Br
InChI=1SC23H19BrN4O2c115122021(2728(2620)186435718)1419(15)2523(29)118161317(24)91022(16)302h314H12H3(H2529)b118+
MFCD02916966
STK083932
ZINC000001185643
ZINC01185643
ZINC1185643

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.