Vitas-M small molecule compound
2-{5-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxybenzyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STL327740
SMILES COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)C=C1C(=O)N(C)C(=S)N(C1=O)C
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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 C23H19N3O5S MW 449.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O5S/c1-24-19(27)17(20(28)25(2)23(24)32)11-13-8-9-18(31-3)14(10-13)12-26-21(29)15-6-4-5-7-16(15)22(26)30/h4-11H,12H2,1-3H3InChIKey
MVBAWTHJJQIWRP-UHFFFAOYSA-NSynonyms
374095-46-22((5((13DIMETHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENYL)METHYL)ISOINDOLE13DIONE
2(5((13dimethyl46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxybenzyl)1Hisoindole13(2H)dione
2(5((13dimethyl46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxybenzyl)isoindoline13dione
374095462
CN1C(=O)C(=CC2=CC(=C(C=C2)OC)CN3C(=O)C4=CC=CC=C4C3=O)C(=O)N(C1=S)C
InChI=1SC23H19N3O5Sc12419(27)17(20(28)25(2)23(24)32)11138918(313)14(1013)122621(29)15645716(15)22(26)30h411H12H213H3
MFCD01951683
ZINC000002283557
ZINC02283557
ZINC2283557
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