Vitas-M small molecule compound
2-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-6-methyl-3-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL093410
SMILES Cc1cc2c([nH]1)c(=O)n(c(n2)SCC(=O)N1CCN(CC1)Cc1ccccc1)c1ccccc1
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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 C26H27N5O2S MW 473.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2S/c1-19-16-22-24(27-19)25(33)31(21-10-6-3-7-11-21)26(28-22)34-18-23(32)30-14-12-29(13-15-30)17-20-8-4-2-5-9-20/h2-11,16,27H,12-15,17-18H2,1H3InChIKey
LZKDOAAQWBUODN-UHFFFAOYSA-NSynonyms
2((2(4benzylpiperazin1yl)2oxoethyl)sulfanyl)6methyl3phenyl35dihydro4Hpyrrolo(32d)pyrimidin4one
2(2(4benzylpiperazin1yl)2oxoethyl)sulfanyl6methyl3phenyl5Hpyrrolo(32d)pyrimidin4one
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5
Cc1cc2c((nH)1)c(=O)n(c(n2)SCC(=O)N1CCN(CC1)Cc1ccccc1)c1ccccc1
InChI=1SC26H27N5O2Sc119162224(2719)25(33)31(21106371121)26(2822)341823(32)30141229(131530)17208425920h2111627H12151718H21H3
MFCD18787544
ZINC000067236854
ZINC67236854
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