Vitas-M small molecule compound

7,7-dimethyl-2-(4-methylphenyl)-4-(methylsulfanyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine

Catalog ID
STK850801
SMILES CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)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 C17H20N2OS MW 300.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2OS/c1-11-5-7-12(8-6-11)15-18-14-9-17(2,3)20-10-13(14)16(19-15)21-4/h5-8H,9-10H2,1-4H3
InChIKey
AQYZYTCEWPXDDJ-UHFFFAOYSA-N
Synonyms
900295-89-8
77dimethyl2(4methylphenyl)4(methylsulfanyl)78dihydro5Hpyrano(43d)pyrimidine
77DIMETHYL2(4METHYLPHENYL)4METHYLSULFANYL58DIHYDROPYRANO(43D)PYRIMIDINE
77dimethyl4(methylthio)2(ptolyl)78dihydro5Hpyrano(43d)pyrimidine
900295898
CC1=CC=C(C=C1)C2=NC3=C(COC(C3)(C)C)C(=N2)SC
InChI=1SC17H20N2OSc1115712(8611)151814917(23)201013(14)16(1915)214h58H910H214H3
MFCD06773083
ZINC000005243330
ZINC05243330
ZINC5243330

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Available files

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