Vitas-M small molecule compound
2-{[6-methyl-4-oxo-3-(propan-2-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-phenylbutan-2-yl)acetamide
Catalog ID
STL103649
SMILES CC(NC(=O)CSc1nc2cc([nH]c2c(=O)n1C(C)C)C)CCc1ccccc1
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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/c1-14(2)26-21(28)20-18(12-16(4)24-20)25-22(26)29-13-19(27)23-15(3)10-11-17-8-6-5-7-9-17/h5-9,12,14-15,24H,10-11,13H2,1-4H3,(H,23,27)InChIKey
KUQKBBOHWZJHNB-UHFFFAOYSA-NSynonyms
2((6methyl4oxo3(propan2yl)45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(4phenylbutan2yl)acetamide
2((6methyl4oxo3propan2yl5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(4phenylbutan2yl)acetamide
CC(NC(=O)CSc1nc2cc((nH)c2c(=O)n1C(C)C)C)CCc1ccccc1
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC(C)CCC3=CC=CC=C3)C(C)C
InChI=1SC22H28N4O2Sc114(2)2621(28)2018(1216(4)2420)2522(26)291319(27)2315(3)1011178657917h5912141524H101113H214H3(H2327)
MFCD20735251
ZINC000067236032
ZINC000067236035
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