Vitas-M small molecule compound

3-bromo-N-{2-[4-(dimethylamino)phenyl]-2H-benzotriazol-5-yl}benzamide

Catalog ID
STK957254
SMILES Brc1cccc(c1)C(=O)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)N(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 C21H18BrN5O MW 436.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN5O/c1-26(2)17-7-9-18(10-8-17)27-24-19-11-6-16(13-20(19)25-27)23-21(28)14-4-3-5-15(22)12-14/h3-13H,1-2H3,(H,23,28)
InChIKey
PDOVLROHMKKRAX-UHFFFAOYSA-N
Synonyms

3BROMON(2(4(DIMETHYLAMINO)PHENYL)2H123BENZOTRIAZOL5YL)BENZAMIDE
3bromoN(2(4(dimethylamino)phenyl)2Hbenzotriazol5yl)benzamide
3bromoN(2(4(dimethylamino)phenyl)benzotriazol5yl)benzamide
CN(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)Br
InChI=1SC21H18BrN5Oc126(2)177918(10817)27241911616(1320(19)2527)2321(28)1443515(22)1214h313H12H3(H2328)
MFCD01145425
ZINC000002737846
ZINC02737846
ZINC2737846

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Available files

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