Vitas-M small molecule compound

5,5'-[(3-hydroxy-4-methoxyphenyl)methanediyl]bis[6-hydroxy-1-methyl-2-(propylsulfanyl)pyrimidin-4(1H)-one]

Catalog ID
STL340829
SMILES CCCSc1nc(=O)c(c(n1C)O)C(c1c(=O)nc(n(c1O)C)SCCC)c1ccc(c(c1)O)OC

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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 C24H30N4O6S2 MW 534.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O6S2/c1-6-10-35-23-25-19(30)17(21(32)27(23)3)16(13-8-9-15(34-5)14(29)12-13)18-20(31)26-24(36-11-7-2)28(4)22(18)33/h8-9,12,16,29,32-33H,6-7,10-11H2,1-5H3
InChIKey
YVIKNSIYGUSCAV-UHFFFAOYSA-N
Synonyms

55((3hydroxy4methoxyphenyl)methanediyl)bis(6hydroxy1methyl2(propylsulfanyl)pyrimidin4(1H)one)
55((3hydroxy4methoxyphenyl)methylene)bis(6hydroxy1methyl2(propylthio)pyrimidin4(1H)one)
6HYDROXY5((3HYDROXY4METHOXYPHENYL)(4HYDROXY1METHYL6OXO2(PROPYLSULFANYL)16DIHYDRO5PYRIMIDINYL)METHYL)3METHYL2(PROPYLSULFANYL)4(3H)PYRIMIDINONE
6HYDROXY5((3HYDROXY4METHOXYPHENYL)(6HYDROXY1METHYL4OXO2PROPYLSULFANYLPYRIMIDIN5YL)METHYL)1METHYL2PROPYLSULFANYLPYRIMIDIN4ONE
CCCSC1=NC(=O)C(=C(N1C)O)C(C2=CC(=C(C=C2)OC)O)C3=C(N(C(=NC3=O)SCCC)C)O
InChI=1SC24H30N4O6S2c161035232519(30)17(21(32)27(23)3)16(138915(345)14(29)1213)1820(31)2624(361172)28(4)22(18)33h891216293233H671011H215H3
MFCD04022699
ZINC000100509375
ZINC08691575
ZINC100509375
ZINC101082054
ZINC70460515
ZINC8691575

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Available files

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