Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-(7H-purin-6-ylsulfanyl)acetamide
Catalog ID
STK618917
SMILES O=C(CSc1ncnc2c1[nH]cn2)NCc1ccc2c(c1)OCO2
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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 C15H13N5O3S MW 343.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5O3S/c21-12(5-24-15-13-14(18-6-17-13)19-7-20-15)16-4-9-1-2-10-11(3-9)23-8-22-10/h1-3,6-7H,4-5,8H2,(H,16,21)(H,17,18,19,20)InChIKey
JEBDEEYAAYKJKB-UHFFFAOYSA-NSynonyms
929968-86-52((9Hpurin6yl)thio)N(benzo(d)(13)dioxol5ylmethyl)acetamide
929968865
C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC=NC4=C3NC=N4
InChI=1SC15H13N5O3Sc2112(524151314(1861713)1972015)1649121011(39)2382210h1367H458H2(H1621)(H17181920)
MFCD09789486
N(13benzodioxol5ylmethyl)2(7Hpurin6ylsulfanyl)acetamide
N(2HBENZO(34D)13DIOXOLEN5YLMETHYL)2PURIN6YLTHIOACETAMIDE
O=C(CSc1ncnc2c1(nH)cn2)NCc1ccc2c(c1)OCO2
O=C(CSc1ncnc2c1nc(nH)2)NCc1ccc2c(c1)OCO2
ZINC000013549907
ZINC13549907
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