Vitas-M small molecule compound

6-hydroxy-3-methyl-8-{[2-(morpholin-4-yl)ethyl]sulfanyl}-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK561952
SMILES C=CCn1c(SCCN2CCOCC2)nc2c1c(O)nc(=O)n2C

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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 C15H21N5O3S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N5O3S/c1-3-4-20-11-12(18(2)14(22)17-13(11)21)16-15(20)24-10-7-19-5-8-23-9-6-19/h3H,1,4-10H2,2H3,(H,17,21,22)
InChIKey
QIAIGHZMYVVDRL-UHFFFAOYSA-N
Synonyms
442865-19-2
3METHYL8(2MORPHOLIN4YLETHYLSULFANYL)7PROP2ENYLPURINE26DIONE
3METHYL8(2MORPHOLIN4YLETHYLTHIO)7PROP2ENYL137TRIHYDROPURINE26DIONE
442865192
6hydroxy3methyl8((2(morpholin4yl)ethyl)sulfanyl)7(prop2en1yl)37dihydro2Hpurin2one
7ALLYL3METHYL8((2MORPHOLINOETHYL)THIO)1HPURINE26(3H7H)DIONE
7ALLYL3METHYL8(2MORPHOLIN4YLETHYLSULFANYL)37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCCN3CCOCC3)CC=C
InChI=1SC15H21N5O3Sc134201112(18(2)14(22)1713(11)21)1615(20)241071958239619h3H1410H22H3(H172122)
MFCD03814338
ZINC000019973501
ZINC19973501

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Available files

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