Vitas-M small molecule compound
(2E)-1-[4-(9H-purin-6-yl)piperazin-1-yl]-3-(thiophen-2-yl)prop-2-en-1-one
Catalog ID
STK719174
SMILES O=C(N1CCN(CC1)c1ncnc2c1nc[nH]2)/C=C/c1cccs1
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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 C16H16N6OS MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6OS/c23-13(4-3-12-2-1-9-24-12)21-5-7-22(8-6-21)16-14-15(18-10-17-14)19-11-20-16/h1-4,9-11H,5-8H2,(H,17,18,19,20)/b4-3+InChIKey
KITQNDWSHUTJPE-ONEGZZNKSA-NSynonyms
1021078-27-2(2E)1(4(9Hpurin6yl)piperazin1yl)3(thiophen2yl)prop2en1one
(E)1(4(7Hpurin6yl)piperazin1yl)3thiophen2ylprop2en1one
(E)1(4(9Hpurin6yl)piperazin1yl)3(thiophen2yl)prop2en1one
1021078272
C1CN(CCN1C2=NC=NC3=C2NC=N3)C(=O)C=CC4=CC=CS4
InChI=1SC16H16N6OSc2313(43122192412)215722(8621)161415(18101714)19112016h14911H58H2(H17181920)b43+
MFCD12202115
O=C(N1CCN(CC1)c1ncnc2c1nc(nH)2)C=Cc1cccs1
ZINC000012323767
ZINC12323767
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