Vitas-M small molecule compound
3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide
Catalog ID
STK626640
SMILES COc1cc(NC(=O)CCSc2nc(Cl)nc3c2[nH]cn3)cc(c1)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 C16H16ClN5O3S MW 393.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN5O3S/c1-24-10-5-9(6-11(7-10)25-2)20-12(23)3-4-26-15-13-14(19-8-18-13)21-16(17)22-15/h5-8H,3-4H2,1-2H3,(H,20,23)(H,18,19,21,22)InChIKey
HGGQWARLUPLPBM-UHFFFAOYSA-NSynonyms
929818-15-53((2chloro7Hpurin6yl)sulfanyl)N(35dimethoxyphenyl)propanamide
3((2chloro9Hpurin6yl)thio)N(35dimethoxyphenyl)propanamide
929818155
COC1=CC(=CC(=C1)NC(=O)CCSC2=NC(=NC3=C2NC=N3)Cl)OC
COc1cc(NC(=O)CCSc2nc(Cl)nc3c2(nH)cn3)cc(c1)OC
COc1cc(NC(=O)CCSc2nc(Cl)nc3c2nc(nH)3)cc(c1)OC
InChI=1SC16H16ClN5O3Sc1241059(611(710)252)2012(23)3426151314(1981813)2116(17)2215h58H34H212H3(H2023)(H18192122)
MFCD09792968
ZINC000013570972
ZINC13570972
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