Vitas-M small molecule compound
ethyl 5-methoxy-3-({[4-(3-methyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STK530301
SMILES CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC
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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 C27H34N8O6 MW 566.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N8O6/c1-5-9-35-22-23(32(3)27(39)31-24(22)37)30-26(35)34-12-10-33(11-13-34)15-19(36)29-20-17-14-16(40-4)7-8-18(17)28-21(20)25(38)41-6-2/h7-8,14,28H,5-6,9-13,15H2,1-4H3,(H,29,36)(H,31,37,39)InChIKey
AVZIVRXOQHSRJN-UHFFFAOYSA-NSynonyms
CCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCN(CC1)CC(=O)Nc1c((nH)c2c1cc(OC)cc2)C(=O)OCC
CCCN1C2=C(N=C1N3CCN(CC3)CC(=O)NC4=C(NC5=C4C=C(C=C5)OC)C(=O)OCC)N(C(=O)NC2=O)C
ethyl5methoxy3(((4(3methyl26dioxo7propyl2367tetrahydro1Hpurin8yl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
ETHYL5METHOXY3((2(4(3METHYL26DIOXO7PROPYLPURIN8YL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
ethyl5methoxy3(2(4(3methyl26dioxo7propyl2367tetrahydro1Hpurin8yl)piperazin1yl)acetamido)1Hindole2carboxylate
InChI=1SC27H34N8O6c159352223(32(3)27(39)3124(22)37)3026(35)34121033(111334)1519(36)2920171416(404)7818(17)2821(20)25(38)4162h781428H5691315H214H3(H2936)(H313739)
MFCD01881471
ZINC000102407818
ZINC102407818
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.