Vitas-M small molecule compound
2-[6-methyl-3-(2-methylpropyl)-2-(methylsulfanyl)-4-oxo-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-[1-(4-methylphenyl)ethyl]acetamide
Catalog ID
STL111687
SMILES CSc1nc2cc(n(c2c(=O)n1CC(C)C)CC(=O)NC(c1ccc(cc1)C)C)C
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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 C23H30N4O2S MW 426.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O2S/c1-14(2)12-27-22(29)21-19(25-23(27)30-6)11-16(4)26(21)13-20(28)24-17(5)18-9-7-15(3)8-10-18/h7-11,14,17H,12-13H2,1-6H3,(H,24,28)InChIKey
IUGMJLOBTZFXLH-UHFFFAOYSA-NSynonyms
2(6methyl3(2methylpropyl)2(methylsulfanyl)4oxo34dihydro5Hpyrrolo(32d)pyrimidin5yl)N(1(4methylphenyl)ethyl)acetamide
2(6methyl3(2methylpropyl)2methylsulfanyl4oxopyrrolo(32d)pyrimidin5yl)N(1(4methylphenyl)ethyl)acetamide
CC1=CC=C(C=C1)C(C)NC(=O)CN2C(=CC3=C2C(=O)N(C(=N3)SC)CC(C)C)C
InChI=1SC23H30N4O2Sc114(2)122722(29)2119(2523(27)306)1116(4)26(21)1320(28)2417(5)189715(3)81018h7111417H1213H216H3(H2428)
MFCD20746568
ZINC000067320154
ZINC000067320157
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