Vitas-M small molecule compound
10a-[(E)-2-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STK576975
SMILES COc1cc(ccc1OCc1cccc(c1)Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1
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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 C29H29ClN2O3 MW 489.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29ClN2O3/c1-28(2)23-9-4-5-10-24(23)32-16-14-27(33)31-29(28,32)15-13-20-11-12-25(26(18-20)34-3)35-19-21-7-6-8-22(30)17-21/h4-13,15,17-18H,14,16,19H2,1-3H3,(H,31,33)/b15-13+InChIKey
SQSODUMIBLHGLD-FYWRMAATSA-NSynonyms
(E)10a(4((3chlorobenzyl)oxy)3methoxystyryl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(4((3chlorobenzyl)oxy)3methoxyphenyl)ethenyl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(4((3chlorophenyl)methoxy)3methoxyphenyl)ethenyl)1010dimethyl34dihydro1Hpyrimido(12a)indol2one
CC1(C2=CC=CC=C2N3C1(NC(=O)CC3)C=CC4=CC(=C(C=C4)OCC5=CC(=CC=C5)Cl)OC)C
COc1cc(ccc1OCc1cccc(c1)Cl)C=CC12NC(=O)CCN1c1c(C2(C)C)cccc1
InChI=1SC29H29ClN2O3c128(2)239451024(23)32161427(33)3129(2832)151320111225(26(1820)343)35192176822(30)1721h413151718H141619H213H3(H3133)b1513+
ZINC000002212020
ZINC000009383374
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