Vitas-M small molecule compound

2-[(4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-1-[4-(propan-2-yl)phenyl]ethanone

Catalog ID
STK524297
SMILES Cc1nc(SCC(=O)c2ccc(cc2)C(C)C)nc(c1)O

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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 C16H18N2O2S MW 302.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O2S/c1-10(2)12-4-6-13(7-5-12)14(19)9-21-16-17-11(3)8-15(20)18-16/h4-8,10H,9H2,1-3H3,(H,17,18,20)
InChIKey
UTMRRIDVCTYSGF-UHFFFAOYSA-N
Synonyms

2((2(4ISOPROPYLPHENYL)2OXOETHYL)THIO)6METHYLPYRIMIDIN4(3H)ONE
2((2KETO2PCUMENYLETHYL)THIO)6METHYL1HPYRIMIDIN4ONE
2((4HYDROXY6METHYLPYRIMIDIN2YL)SULFANYL)1(4(PROPAN2YL)PHENYL)ETHAN1ONE
2((4hydroxy6methylpyrimidin2yl)sulfanyl)1(4(propan2yl)phenyl)ethanone
2(4HYDROXY6METHYLPYRIMIDIN2YLSULFANYL)1(4ISOPROPYLPHENYL)ETHANONE
6METHYL2((2OXO2(4PROPAN2YLPHENYL)ETHYL)THIO)1HPYRIMIDIN4ONE
6METHYL2(2OXIDANYLIDENE2(4PROPAN2YLPHENYL)ETHYL)SULFANYL1HPYRIMIDIN4ONE
6METHYL2(2OXO2(4PROPAN2YLPHENYL)ETHYL)SULFANYL1HPYRIMIDIN4ONE
CC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)C(C)C
InChI=1SC16H18N2O2Sc110(2)124613(7512)14(19)921161711(3)815(20)1816h4810H9H213H3(H171820)
MFCD02366436
ZINC000018156873
ZINC18156873

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Available files

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