Vitas-M small molecule compound
N-cyclohexyl-2-[3'-methyl-2,6'-dioxo-1'-(7H-purin-6-yl)-1',5',6',7'-tetrahydrospiro[indole-3,4'-pyrazolo[3,4-b]pyridin]-1(2H)-yl]acetamide
Catalog ID
STL491600
SMILES O=C(CN1c2ccccc2C2(C1=O)CC(=O)Nc1c2c(C)nn1c1ncnc2c1[nH]cn2)NC1CCCCC1
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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 C27H27N9O3 MW 525.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N9O3/c1-15-21-24(36(34-15)25-22-23(29-13-28-22)30-14-31-25)33-19(37)11-27(21)17-9-5-6-10-18(17)35(26(27)39)12-20(38)32-16-7-3-2-4-8-16/h5-6,9-10,13-14,16H,2-4,7-8,11-12H2,1H3,(H,32,38)(H,33,37)(H,28,29,30,31)InChIKey
HDPFNKCYMHNYOD-UHFFFAOYSA-NSynonyms
MFCD30714611
Ncyclohexyl2(3methyl26dioxo1(7Hpurin6yl)1567tetrahydrospiro(indole34pyrazolo(34b)pyridin)1(2H)yl)acetamide
Ncyclohexyl2(3methyl26dioxo1(9Hpurin6yl)1567tetrahydrospiro(indoline34pyrazolo(34b)pyridin)1yl)acetamide
O=C(CN1c2ccccc2C2(C1=O)CC(=O)Nc1c2c(C)nn1c1ncnc2c1(nH)cn2)NC1CCCCC1
O=C(CN1c2ccccc2C2(C1=O)CC(=O)Nc1c2c(C)nn1c1ncnc2c1nc(nH)2)NC1CCCCC1
ZINC000095476327
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