Vitas-M small molecule compound

N-(2,4-dimethoxyphenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide

Catalog ID
STK497007
SMILES COc1cc(OC)ccc1NC(=O)CSc1nc2c(n1C)nc[nH]c2=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 C16H17N5O4S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O4S/c1-21-14-13(15(23)18-8-17-14)20-16(21)26-7-12(22)19-10-5-4-9(24-2)6-11(10)25-3/h4-6,8H,7H2,1-3H3,(H,19,22)(H,17,18,23)
InChIKey
ZBTFDTYEVFRKCR-UHFFFAOYSA-N
Synonyms

CN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=C(C=C(C=C3)OC)OC
COc1cc(OC)ccc1NC(=O)CSc1nc2c(n1C)nc(nH)c2=O
InChI=1SC16H17N5O4Sc1211413(15(23)1881714)2016(21)26712(22)1910549(242)611(10)253h468H7H213H3(H1922)(H171823)
MFCD09788407
N(24dimethoxyphenyl)2((9methyl6oxo3Hpurin8yl)sulfanyl)acetamide
N(24dimethoxyphenyl)2((9methyl6oxo69dihydro1Hpurin8yl)sulfanyl)acetamide
N(24DIMETHOXYPHENYL)2(9METHYL6OXOHYDROPURIN8YLTHIO)ACETAMIDE
ZINC000012427856
ZINC12427856

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Available files

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