Vitas-M small molecule compound
2-[(6-amino-9H-purin-8-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
Catalog ID
STK710740
SMILES COc1ccccc1N1CCN(CC1)C(=O)CSc1nc2c([nH]1)ncnc2N
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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 C18H21N7O2S MW 399.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N7O2S/c1-27-13-5-3-2-4-12(13)24-6-8-25(9-7-24)14(26)10-28-18-22-15-16(19)20-11-21-17(15)23-18/h2-5,11H,6-10H2,1H3,(H3,19,20,21,22,23)InChIKey
DEVICDXASPGEDX-UHFFFAOYSA-NSynonyms
2((6AMINO7HPURIN8YL)SULFANYL)1(4(2METHOXYPHENYL)PIPERAZIN1YL)ETHANONE
2((6amino9Hpurin8yl)sulfanyl)1(4(2methoxyphenyl)piperazin1yl)ethanone
8((2(4(2METHOXYPHENYL)1PIPERAZINYL)2OXOETHYL)THIO)9HPURIN6AMINE
COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC4=C(N3)C(=NC=N4)N
COc1ccccc1N1CCN(CC1)C(=O)CSc1nc2c((nH)1)ncnc2N
InChI=1SC18H21N7O2Sc12713532412(13)246825(9724)14(26)102818221516(19)20112117(15)2318h2511H610H21H3(H31920212223)
MFCD05838238
ZINC000001062228
ZINC01062228
ZINC1062228
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