Vitas-M small molecule compound

2-{[6-methyl-3-(2-methylpropyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide

Catalog ID
STL103853
SMILES COc1cc(NC(=O)CSc2nc3cc([nH]c3c(=O)n2CC(C)C)C)cc(c1OC)OC

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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 C22H28N4O5S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5S/c1-12(2)10-26-21(28)19-15(7-13(3)23-19)25-22(26)32-11-18(27)24-14-8-16(29-4)20(31-6)17(9-14)30-5/h7-9,12,23H,10-11H2,1-6H3,(H,24,27)
InChIKey
JDNBWLRVOFEGTI-UHFFFAOYSA-N
Synonyms

2((6methyl3(2methylpropyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(345trimethoxyphenyl)acetamide
2((6methyl3(2methylpropyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(345trimethoxyphenyl)acetamide
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC(=C(C(=C3)OC)OC)OC)CC(C)C
COc1cc(NC(=O)CSc2nc3cc((nH)c3c(=O)n2CC(C)C)C)cc(c1OC)OC
InChI=1SC22H28N4O5Sc112(2)102621(28)1915(713(3)2319)2522(26)321118(27)2414816(294)20(316)17(914)305h791223H1011H216H3(H2427)
MFCD20735455
ZINC000067237842
ZINC67237842

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Available files

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