Vitas-M small molecule compound
1-(4-methoxyphenyl)-2-(9H-purin-6-ylsulfanyl)ethanone
Catalog ID
STK278568
SMILES COc1ccc(cc1)C(=O)CSc1ncnc2c1nc[nH]2
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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 C14H12N4O2S MW 300.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O2S/c1-20-10-4-2-9(3-5-10)11(19)6-21-14-12-13(16-7-15-12)17-8-18-14/h2-5,7-8H,6H2,1H3,(H,15,16,17,18)InChIKey
VBTRZZQWTVNSME-UHFFFAOYSA-NSynonyms
80985-26-81(4METHOXYPHENYL)2(7HPURIN6YLSULFANYL)ETHANONE
1(4methoxyphenyl)2(9Hpurin6ylsulfanyl)ethanone
2((7Hpurin6yl)thio)1(4methoxyphenyl)ethanone
80985268
COC1=CC=C(C=C1)C(=O)CSC2=NC=NC3=C2NC=N3
COc1ccc(cc1)C(=O)CSc1ncnc2c1(nH)cn2
COc1ccc(cc1)C(=O)CSc1ncnc2c1nc(nH)2
InChI=1SC14H12N4O2Sc12010429(3510)11(19)621141213(1671512)1781814h2578H6H21H3(H15161718)
MFCD09269363
ZINC000018149169
ZINC18149169
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