Vitas-M small molecule compound
2-(4-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}butyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STL296615
SMILES CC(=C)Cn1c(SCCCCN2C(=O)c3c(C2=O)cccc3)nc2c(c1=O)c1CCCCc1s2
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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 C26H27N3O3S2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S2/c1-16(2)15-29-25(32)21-19-11-5-6-12-20(19)34-22(21)27-26(29)33-14-8-7-13-28-23(30)17-9-3-4-10-18(17)24(28)31/h3-4,9-10H,1,5-8,11-15H2,2H3InChIKey
CNWSOGRSFFGUTQ-UHFFFAOYSA-NSynonyms
371946-94-02(4((3(2methylallyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)butyl)isoindoline13dione
2(4((3(2methylprop2en1yl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)butyl)1Hisoindole13(2H)dione
2(4((3(2methylprop2enyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)butyl)isoindole13dione
371946940
CC(=C)CN1C(=O)C2=C(N=C1SCCCCN3C(=O)C4=CC=CC=C4C3=O)SC5=C2CCCC5
InChI=1SC26H27N3O3S2c116(2)152925(32)211911561220(19)3422(21)2726(29)331487132823(30)179341018(17)24(28)31h34910H1581115H22H3
MFCD01856437
ZINC000002268676
ZINC02268676
ZINC2268676
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