Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-(7H-purin-6-ylsulfanyl)propanamide
Catalog ID
STK623488
SMILES O=C(C(Sc1ncnc2c1[nH]cn2)C)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 C16H15N5O3S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O3S/c1-9(25-16-13-14(19-6-18-13)20-7-21-16)15(22)17-5-10-2-3-11-12(4-10)24-8-23-11/h2-4,6-7,9H,5,8H2,1H3,(H,17,22)(H,18,19,20,21)InChIKey
IDTJWKFEUSKPKH-UHFFFAOYSA-NSynonyms
929811-44-92((9Hpurin6yl)thio)N(benzo(d)(13)dioxol5ylmethyl)propanamide
929811449
CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SC3=NC=NC4=C3NC=N4
InChI=1SC16H15N5O3Sc19(25161314(1961813)2072116)15(22)17510231112(410)2482311h24679H58H21H3(H1722)(H18192021)
MFCD09796821
N(13benzodioxol5ylmethyl)2(7Hpurin6ylsulfanyl)propanamide
O=C(C(Sc1ncnc2c1(nH)cn2)C)NCc1ccc2c(c1)OCO2
O=C(C(Sc1ncnc2c1nc(nH)2)C)NCc1ccc2c(c1)OCO2
ZINC000009421726
ZINC000009421727
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