Vitas-M small molecule compound
3-[(2-hydroxyethoxy)methyl]-7-(2-phenylethyl)-5,6,7,8-tetrahydro[1,3,5]triazino[1,2-a]purin-10(3H)-one
Catalog ID
STK654376
SMILES OCCOCn1cnc2c1nc1NCN(Cn1c2=O)CCc1ccccc1
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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 C18H22N6O3 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O3/c25-8-9-27-13-23-11-19-15-16(23)21-18-20-10-22(12-24(18)17(15)26)7-6-14-4-2-1-3-5-14/h1-5,11,25H,6-10,12-13H2,(H,20,21)InChIKey
COCGDXRGYSLVHD-UHFFFAOYSA-NSynonyms
1144446-23-01144446230
3((2hydroxyethoxy)methyl)7(2phenylethyl)5678tetrahydro(135)triazino(12a)purin10(3H)one
3((2hydroxyethoxy)methyl)7phenethyl5678tetrahydro(135)triazino(12a)purin10(3H)one
3(2hydroxyethoxymethyl)7(2phenylethyl)68dihydro4H(135)triazino(12a)purin10one
C1N=C2NC3=C(C(=O)N2CN1CCC4=CC=CC=C4)N=CN3COCCO
InChI=1SC18H22N6O3c258927132311191516(23)2118201022(1224(18)17(15)26)76144213514h151125H6101213H2(H2021)
MFCD12210836
ZINC000032069800
ZINC32069800
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