Vitas-M small molecule compound
methyl 2-({[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK496977
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2c(n1C)nc[nH]c2=O
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C16H15N5O4S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O4S/c1-21-13-12(14(23)18-8-17-13)20-16(21)26-7-11(22)19-10-6-4-3-5-9(10)15(24)25-2/h3-6,8H,7H2,1-2H3,(H,19,22)(H,17,18,23)InChIKey
ILCNEOMCPLRRAF-UHFFFAOYSA-NSynonyms
CN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=CC=CC=C3C(=O)OC
COC(=O)c1ccccc1NC(=O)CSc1nc2c(n1C)nc(nH)c2=O
InChI=1SC16H15N5O4Sc1211312(14(23)1881713)2016(21)26711(22)191064359(10)15(24)252h368H7H212H3(H1922)(H171823)
methyl2((((9methyl6oxo69dihydro1Hpurin8yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((9methyl6oxo3Hpurin8yl)sulfanyl)acetyl)amino)benzoate
METHYL2(2(9METHYL6OXOHYDROPURIN8YLTHIO)ACETYLAMINO)BENZOATE
MFCD09788381
ZINC000012427863
ZINC12427863
Check stock
See real-time availability and sample size for STK496977 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.