Vitas-M small molecule compound

5-benzyl-6-methyl-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyrimidin-4(3H)-one

Catalog ID
STK710738
SMILES O=C(N1CCN(CC1)c1ccccc1)CSc1nc(C)c(c(=O)[nH]1)Cc1ccccc1

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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 C24H26N4O2S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O2S/c1-18-21(16-19-8-4-2-5-9-19)23(30)26-24(25-18)31-17-22(29)28-14-12-27(13-15-28)20-10-6-3-7-11-20/h2-11H,12-17H2,1H3,(H,25,26,30)
InChIKey
MAQSWFDZEDUYBD-UHFFFAOYSA-N
Synonyms

5BENZYL6METHYL2((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)PYRIMIDIN4(1H)ONE
5BENZYL6METHYL2((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)PYRIMIDIN4(3H)ONE
5BENZYL6METHYL2(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL1HPYRIMIDIN4ONE
CC1=C(C(=O)N=C(N1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3)CC4=CC=CC=C4
InChI=1SC24H26N4O2Sc11821(16198425919)23(30)2624(2518)311722(29)28141227(131528)20106371120h211H1217H21H3(H252630)
MFCD05838228
O=C(N1CCN(CC1)c1ccccc1)CSc1nc(C)c(c(=O)(nH)1)Cc1ccccc1
ZINC000009409406
ZINC9409406

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Available files

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