Vitas-M small molecule compound

2-[(2,3-dimethylphenoxy)methyl]-12-(4-methoxyphenyl)-9,9-dimethyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one

Catalog ID
STL239677
SMILES COc1ccc(cc1)C1C2=C(Oc3c1c1nc(nn1cn3)COc1cccc(c1C)C)CC(CC2=O)(C)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 C30H30N4O4 MW 510.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N4O4/c1-17-7-6-8-22(18(17)2)37-15-24-32-28-27-25(19-9-11-20(36-5)12-10-19)26-21(35)13-30(3,4)14-23(26)38-29(27)31-16-34(28)33-24/h6-12,16,25H,13-15H2,1-5H3
InChIKey
NYDVFLIBTOJBKO-UHFFFAOYSA-N
Synonyms
847244-41-1
2((23dimethylphenoxy)methyl)12(4methoxyphenyl)99dimethyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
2((23dimethylphenoxy)methyl)12(4methoxyphenyl)99dimethyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
847244411
CC1=C(C(=CC=C1)OCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)CC(CC5=O)(C)C)C6=CC=C(C=C6)OC)C
InChI=1SC30H30N4O4c11776822(18(17)2)37152432282725(1991120(365)121019)2621(35)1330(34)1423(26)3829(27)311634(28)3324h6121625H1315H215H3
MFCD04174398
ZINC000002441529
ZINC000002441531

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Available files

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