Vitas-M small molecule compound
3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)propanamide
Catalog ID
STK629569
SMILES COc1cc(NC(=O)CCSc2nc(Cl)nc3c2[nH]cn3)cc(c1OC)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 C17H18ClN5O4S MW 423.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN5O4S/c1-25-10-6-9(7-11(26-2)14(10)27-3)21-12(24)4-5-28-16-13-15(20-8-19-13)22-17(18)23-16/h6-8H,4-5H2,1-3H3,(H,21,24)(H,19,20,22,23)InChIKey
ZYRGCMBBXVVFRK-UHFFFAOYSA-NSynonyms
929821-56-73((2chloro7Hpurin6yl)sulfanyl)N(345trimethoxyphenyl)propanamide
3((2chloro9Hpurin6yl)thio)N(345trimethoxyphenyl)propanamide
929821567
COC1=CC(=CC(=C1OC)OC)NC(=O)CCSC2=NC(=NC3=C2NC=N3)Cl
COc1cc(NC(=O)CCSc2nc(Cl)nc3c2(nH)cn3)cc(c1OC)OC
COc1cc(NC(=O)CCSc2nc(Cl)nc3c2nc(nH)3)cc(c1OC)OC
InChI=1SC17H18ClN5O4Sc1251069(711(262)14(10)273)2112(24)4528161315(2081913)2217(18)2316h68H45H213H3(H2124)(H19202223)
MFCD09788765
ZINC000013548435
ZINC13548435
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