Vitas-M small molecule compound
6-hydroxy-3-methyl-7-{2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethyl}-8-(pyrrolidin-1-yl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK566865
SMILES Cc1csc(n1)SCCn1c(nc2c1c(O)nc(=O)n2C)N1CCCC1
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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 C16H20N6O2S2 MW 392.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O2S2/c1-10-9-26-16(17-10)25-8-7-22-11-12(20(2)15(24)19-13(11)23)18-14(22)21-5-3-4-6-21/h9H,3-8H2,1-2H3,(H,19,23,24)InChIKey
FJRJCKDRSFNJRI-UHFFFAOYSA-NSynonyms
476482-59-43METHYL7(2((4METHYL13THIAZOL2YL)SULFANYL)ETHYL)8PYRROLIDIN1YLPURINE26DIONE
3METHYL7(2((4METHYLTHIAZOL2YL)THIO)ETHYL)8(PYRROLIDIN1YL)1HPURINE26(3H7H)DIONE
3METHYL7(2(4METHYL(13THIAZOL2YLTHIO))ETHYL)8PYRROLIDINYL137TRIHYDROPURINE26DIONE
476482594
6hydroxy3methyl7(2((4methyl13thiazol2yl)sulfanyl)ethyl)8(pyrrolidin1yl)37dihydro2Hpurin2one
CC1=CSC(=N1)SCCN2C3=C(N=C2N4CCCC4)N(C(=O)NC3=O)C
InChI=1SC16H20N6O2S2c11092616(1710)2587221112(20(2)15(24)1913(11)23)1814(22)21534621h9H38H212H3(H192324)
MFCD05732650
ZINC000004040605
ZINC04040605
ZINC4040605
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