Vitas-M small molecule compound
3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-[2-(4-hydroxyphenyl)ethyl]propanamide
Catalog ID
STK626140
SMILES O=C(CCSc1nc(Cl)nc2c1[nH]cn2)NCCc1ccc(cc1)O
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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 C16H16ClN5O2S MW 377.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN5O2S/c17-16-21-14-13(19-9-20-14)15(22-16)25-8-6-12(24)18-7-5-10-1-3-11(23)4-2-10/h1-4,9,23H,5-8H2,(H,18,24)(H,19,20,21,22)InChIKey
IHORUFAOQRBFBA-UHFFFAOYSA-NSynonyms
929852-22-23((2chloro7Hpurin6yl)sulfanyl)N(2(4hydroxyphenyl)ethyl)propanamide
3((2chloro9Hpurin6yl)thio)N(4hydroxyphenethyl)propanamide
929852222
C1=CC(=CC=C1CCNC(=O)CCSC2=NC(=NC3=C2NC=N3)Cl)O
InChI=1SC16H16ClN5O2Sc1716211413(1992014)15(2216)258612(24)1875101311(23)4210h14923H58H2(H1824)(H19202122)
MFCD09797800
O=C(CCSc1nc(Cl)nc2c1(nH)cn2)NCCc1ccc(cc1)O
O=C(CCSc1nc(Cl)nc2c1nc(nH)2)NCCc1ccc(cc1)O
ZINC000009421206
ZINC09421206
ZINC9421206
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