Vitas-M small molecule compound

2-[(2,3-dimethylphenoxy)methyl]-9-methyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STK589864
SMILES CN1CCc2c(C1)sc1c2c2nc(nn2cn1)COc1cccc(c1C)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 C20H21N5OS MW 379.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5OS/c1-12-5-4-6-15(13(12)2)26-10-17-22-19-18-14-7-8-24(3)9-16(14)27-20(18)21-11-25(19)23-17/h4-6,11H,7-10H2,1-3H3
InChIKey
DASWBBVQBPPIFK-UHFFFAOYSA-N
Synonyms
903206-73-5
2((23dimethylphenoxy)methyl)9methyl891011tetrahydropyrido(4345)thieno(32e)(124)triazolo(15c)pyrimidine
903206735
CC1=C(C(=CC=C1)OCC2=NN3C=NC4=C(C3=N2)C5=C(S4)CN(CC5)C)C
InChI=1SC20H21N5OSc11254615(13(12)2)261017221918147824(3)916(14)2720(18)211125(19)2317h4611H710H213H3
MFCD06793755
ZINC000020567068
ZINC20567068

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Available files

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