Vitas-M small molecule compound
6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-2-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Catalog ID
STL422548
SMILES Oc1c(=O)cc(oc1CN1CCN(CC1)S(=O)(=O)C)CN1CCc2c(C1)cccc2
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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 C21H27N3O5S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5S/c1-30(27,28)24-10-8-22(9-11-24)15-20-21(26)19(25)12-18(29-20)14-23-7-6-16-4-2-3-5-17(16)13-23/h2-5,12,26H,6-11,13-15H2,1H3InChIKey
BNHIPCUYGCBCBH-UHFFFAOYSA-NSynonyms
6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy2((4(methylsulfonyl)piperazin1yl)methyl)4Hpyran4one
6(34dihydro1Hisoquinolin2ylmethyl)3hydroxy2((4methylsulfonylpiperazin1yl)methyl)pyran4one
6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy2((4(methylsulfonyl)piperazin1yl)methyl)4Hpyran4one
CS(=O)(=O)N1CCN(CC1)CC2=C(C(=O)C=C(O2)CN3CCC4=CC=CC=C4C3)O
InChI=1SC21H27N3O5Sc130(2728)2410822(91124)152021(26)19(25)1218(2920)14237616423517(16)1323h251226H6111315H21H3
MFCD29058135
ZINC000252479824
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