Vitas-M small molecule compound

N-[2-(4-methoxyphenyl)ethyl]-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide

Catalog ID
STK604070
SMILES COc1ccc(cc1)CCNC(=O)C(n1nnc2c(c1=O)cccc2)C(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 C21H24N4O3 MW 380.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3/c1-14(2)19(25-21(27)17-6-4-5-7-18(17)23-24-25)20(26)22-13-12-15-8-10-16(28-3)11-9-15/h4-11,14,19H,12-13H2,1-3H3,(H,22,26)
InChIKey
DGYBPXRJIDOOQD-UHFFFAOYSA-N
Synonyms
919725-54-5
919725545
CC(C)C(C(=O)NCCC1=CC=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=N2
InChI=1SC21H24N4O3c114(2)19(2521(27)17645718(17)232425)20(26)2213121581016(283)11915h4111419H1213H213H3(H2226)
MFCD08748729
N(2(4methoxyphenyl)ethyl)3methyl2(4oxo123benzotriazin3(4H)yl)butanamide
N(2(4methoxyphenyl)ethyl)3methyl2(4oxo123benzotriazin3yl)butanamide
N(4methoxyphenethyl)3methyl2(4oxobenzo(d)(123)triazin3(4H)yl)butanamide
ZINC000009341772
ZINC000009341773

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Available files

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