Vitas-M small molecule compound
2-{[3-(butan-2-yl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Catalog ID
STL093824
SMILES COc1ccc(cc1NC(=O)CSc1nc2cc([nH]c2c(=O)n1C(CC)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 C21H26N4O3S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O3S/c1-6-14(4)25-20(27)19-16(10-13(3)22-19)24-21(25)29-11-18(26)23-15-9-12(2)7-8-17(15)28-5/h7-10,14,22H,6,11H2,1-5H3,(H,23,26)InChIKey
SVGKOACWVKQZBJ-UHFFFAOYSA-NSynonyms
2((3(butan2yl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2methoxy5methylphenyl)acetamide
2((3butan2yl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2methoxy5methylphenyl)acetamide
CCC(C)N1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NC3=C(C=CC(=C3)C)OC
COc1ccc(cc1NC(=O)CSc1nc2cc((nH)c2c(=O)n1C(CC)C)C)C
InChI=1SC21H26N4O3Sc1614(4)2520(27)1916(1013(3)2219)2421(25)291118(26)2315912(2)7817(15)285h7101422H611H215H3(H2326)
MFCD18787958
ZINC000067239122
ZINC000067239125
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