Vitas-M small molecule compound
N-butyl-N-ethyl-2-{[6-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093430
SMILES CCCCN(C(=O)CSc1nc2cc([nH]c2c(=O)n1c1ccc(cc1)C)C)CC
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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 C22H28N4O2S MW 412.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O2S/c1-5-7-12-25(6-2)19(27)14-29-22-24-18-13-16(4)23-20(18)21(28)26(22)17-10-8-15(3)9-11-17/h8-11,13,23H,5-7,12,14H2,1-4H3InChIKey
LESPBMAVXLDFJL-UHFFFAOYSA-NSynonyms
CCCCN(C(=O)CSc1nc2cc((nH)c2c(=O)n1c1ccc(cc1)C)C)CC
CCCCN(CC)C(=O)CSC1=NC2=C(C(=O)N1C3=CC=C(C=C3)C)NC(=C2)C
InChI=1SC22H28N4O2Sc1571225(62)19(27)14292224181316(4)2320(18)21(28)26(22)1710815(3)91117h8111323H571214H214H3
MFCD18787564
NbutylNethyl2((6methyl3(4methylphenyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
NbutylNethyl2((6methyl3(4methylphenyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237016
ZINC67237016
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