Vitas-M small molecule compound

2-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-phenylpyrimidin-4(1H)-one

Catalog ID
STK039645
SMILES Cc1ccc(cc1)c1noc(n1)CSc1nc(=O)cc([nH]1)c1ccccc1

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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 C20H16N4O2S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O2S/c1-13-7-9-15(10-8-13)19-23-18(26-24-19)12-27-20-21-16(11-17(25)22-20)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,21,22,25)
InChIKey
JHRODXOZCJSZBK-UHFFFAOYSA-N
Synonyms
433253-96-4
2(((3(4METHYLPHENYL)124OXADIAZOL5YL)METHYL)SULFANYL)6PHENYLPYRIMIDIN4(1H)ONE
2(((3(4METHYLPHENYL)124OXADIAZOL5YL)METHYL)SULFANYL)6PHENYLPYRIMIDIN4(3H)ONE
2((3(4METHYLPHENYL)124OXADIAZOL5YL)METHYLSULFANYL)6PHENYL1HPYRIMIDIN4ONE
6PHENYL2(((3(PTOLYL)124OXADIAZOL5YL)METHYL)THIO)PYRIMIDIN4(3H)ONE
CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC(=O)C=C(N3)C4=CC=CC=C4
Cc1ccc(cc1)c1noc(n1)CSc1nc(=O)cc((nH)1)c1ccccc1
InChI=1SC20H16N4O2Sc1137915(10813)192318(262419)1227202116(1117(25)2220)145324614h211H12H21H3(H212225)
MFCD03145651
STK039645
ZINC5095322

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Available files

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