Vitas-M small molecule compound

ethyl 1-[4-ethoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]-5-phenyl-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STK774698
SMILES CCOC(=O)c1nnn(c1c1ccccc1)c1nc(OCC)nc(n1)N1CCOCC1

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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 C20H23N7O4 MW 425.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7O4/c1-3-30-17(28)15-16(14-8-6-5-7-9-14)27(25-24-15)19-21-18(22-20(23-19)31-4-2)26-10-12-29-13-11-26/h5-9H,3-4,10-13H2,1-2H3
InChIKey
LEVVKMYLMWHZGP-UHFFFAOYSA-N
Synonyms

CCOC1=NC(=NC(=N1)N2CCOCC2)N3C(=C(N=N3)C(=O)OCC)C4=CC=CC=C4
ethyl1(4ethoxy6(morpholin4yl)135triazin2yl)5phenyl1H123triazole4carboxylate
ETHYL1(4ETHOXY6MORPHOLIN4YL135TRIAZIN2YL)5PHENYLTRIAZOLE4CARBOXYLATE
InChI=1SC20H23N7O4c133017(28)1516(148657914)27(252415)192118(2220(2319)3142)26101229131126h59H341013H212H3
MFCD04061158
ZINC000001446089
ZINC01446089
ZINC1446089

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Available files

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