Vitas-M small molecule compound

ethyl [(8-phenyl-2,3,4,8-tetrahydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidin-6-yl)sulfanyl]acetate

Catalog ID
STK633403
SMILES CCOC(=O)CSc1nc2c(c3=NCCCn13)cnn2c1ccccc1

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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 C18H19N5O2S MW 369.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O2S/c1-2-25-15(24)12-26-18-21-17-14(16-19-9-6-10-22(16)18)11-20-23(17)13-7-4-3-5-8-13/h3-5,7-8,11H,2,6,9-10,12H2,1H3
InChIKey
ANUGBYASCWJQIE-UHFFFAOYSA-N
Synonyms
1010889-44-7
1010889447
CCOC(=O)CSC1=NC2=C(C=NN2C3=CC=CC=C3)C4=NCCCN41
ethyl((8phenyl2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidin6yl)sulfanyl)acetate
ethyl2((8phenyl2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidin6yl)thio)acetate
InChI=1SC18H19N5O2Sc122515(24)122618211714(1619961022(16)18)112023(17)137435813h357811H2691012H21H3
MFCD12203437
ZINC000012406966
ZINC12406966

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Available files

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