Vitas-M small molecule compound

9a-[(E)-2-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}ethenyl]-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one

Catalog ID
STL003757
SMILES COc1cc(ccc1OCc1ccc(cc1)C)/C=C/C12NC(=O)CN1c1c(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 C29H30N2O3 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O3/c1-20-9-11-22(12-10-20)19-34-25-14-13-21(17-26(25)33-4)15-16-29-28(2,3)23-7-5-6-8-24(23)31(29)18-27(32)30-29/h5-17H,18-19H2,1-4H3,(H,30,32)/b16-15+
InChIKey
KCVAVKCYMVJRHQ-FOCLMDBBSA-N
Synonyms
847034-53-1
(E)9a(3methoxy4((4methylbenzyl)oxy)styryl)99dimethyl99adihydro1Himidazo(12a)indol2(3H)one
3A((E)2(3METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)ETHENYL)44DIMETHYL13DIHYDROIMIDAZO(12A)INDOL2ONE
847034531
9a((E)2(3methoxy4((4methylbenzyl)oxy)phenyl)ethenyl)99dimethyl99adihydro1Himidazo(12a)indol2(3H)one
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C=CC34C(C5=CC=CC=C5N3CC(=O)N4)(C)C)OC
COc1cc(ccc1OCc1ccc(cc1)C)C=CC12NC(=O)CN1c1c(C2(C)C)cccc1
InChI=1SC29H30N2O3c12091122(121020)193425141321(1726(25)334)15162928(23)23756824(23)31(29)1827(32)3029h517H1819H214H3(H3032)b1615+
MFCD04178051
ZINC000009158108
ZINC000009158109

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Available files

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