Vitas-M small molecule compound
3-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL422081
SMILES O=C(N1CCN(CC1)C/C=C/c1ccccc1)Cn1cnc2c(c1=O)scc2
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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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c26-19(15-25-16-22-18-8-14-28-20(18)21(25)27)24-12-10-23(11-13-24)9-4-7-17-5-2-1-3-6-17/h1-8,14,16H,9-13,15H2/b7-4+InChIKey
DLCSLVWUOHUFIG-QPJJXVBHSA-NSynonyms
1574537-11-3(E)3(2(4cinnamylpiperazin1yl)2oxoethyl)thieno(32d)pyrimidin4(3H)one
1574537113
3(2oxo2(4((2E)3phenylprop2en1yl)piperazin1yl)ethyl)thieno(32d)pyrimidin4(3H)one
3(2oxo2(4((E)3phenylprop2enyl)piperazin1yl)ethyl)thieno(32d)pyrimidin4one
C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)SC=C4
InChI=1SC21H22N4O2Sc2619(15251622188142820(18)21(25)27)24121023(111324)947175213617h181416H91315H2b74+
MFCD28058115
O=C(N1CCN(CC1)CC=Cc1ccccc1)Cn1cnc2c(c1=O)scc2
ZINC000031788785
ZINC31788785
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