Vitas-M small molecule compound
2-(3-methoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK033351
SMILES C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1OC)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C29H30N2O5S MW 518.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O5S/c1-4-7-18-10-12-21(23(16-18)33-2)35-14-15-36-22-13-11-19(17-24(22)34-3)27-30-28(32)26-20-8-5-6-9-25(20)37-29(26)31-27/h4,10-13,16-17H,1,5-9,14-15H2,2-3H3,(H,30,31,32)InChIKey
INOAAEGEWAQJJM-UHFFFAOYSA-NSynonyms
2(3methoxy4(2(2methoxy4(prop2en1yl)phenoxy)ethoxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3methoxy4(2(2methoxy4prop2enylphenoxy)ethoxy)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1OC)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
COC1=C(C=CC(=C1)CC=C)OCCOC2=C(C=C(C=C2)C3=NC4=C(C5=C(S4)CCCC5)C(=O)N3)OC
InChI=1SC29H30N2O5Sc14718101221(23(1618)332)3514153622131119(1724(22)343)273028(32)2620856925(20)3729(26)3127h410131617H1591415H223H3(H303132)
MFCD03183969
STK033351
ZINC000013941751
ZINC13941751
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