Vitas-M small molecule compound
10a-[(E)-2-(3-ethoxy-4-propoxyphenyl)ethenyl]-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL529251
SMILES CCCOc1ccc(cc1OCC)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C
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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 C27H34N2O3 MW 434.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O3/c1-6-16-32-23-11-9-20(18-24(23)31-7-2)12-14-27-26(4,5)21-17-19(3)8-10-22(21)29(27)15-13-25(30)28-27/h8-12,14,17-18H,6-7,13,15-16H2,1-5H3,(H,28,30)/b14-12+InChIKey
MJLBZDDHZPUNCU-WYMLVPIESA-NSynonyms
(E)10a(3ethoxy4propoxystyryl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10~(a)((~(E))2(3ethoxy4propoxyphenyl)ethenyl)81010trimethyl34dihydro1~(H)pyrimido(12a)indol2one
10a((E)2(3ethoxy4propoxyphenyl)ethenyl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
6216883
CCCOc1ccc(cc1OCC)C=CC12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C
InChI=1SC27H34N2O3c1616322311920(1824(23)3172)12142726(45)211719(3)81022(21)29(27)151325(30)2827h812141718H67131516H215H3(H2830)b1412+
MFCD06495747
ZINC000002138130
ZINC000008789731
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