Vitas-M small molecule compound

2-benzyl-12-(3,4-dimethoxyphenyl)-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
STK945406
SMILES COc1ccc(cc1OC)C1C2=C(Oc3c1c1nc(nn1cn3)Cc1ccccc1)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 C29H28N4O4 MW 496.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O4/c1-29(2)14-19(34)25-22(15-29)37-28-26(24(25)18-10-11-20(35-3)21(13-18)36-4)27-31-23(32-33(27)16-30-28)12-17-8-6-5-7-9-17/h5-11,13,16,24H,12,14-15H2,1-4H3
InChIKey
QWFBUXILXKHPCB-UHFFFAOYSA-N
Synonyms
844661-68-3
2benzyl12(34dimethoxyphenyl)99dimethyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
2benzyl12(34dimethoxyphenyl)99dimethyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
844661683
CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)CC5=CC=CC=C5)C6=CC(=C(C=C6)OC)OC)C(=O)C1)C
InChI=1SC29H28N4O4c129(2)1419(34)2522(1529)372826(24(25)18101120(353)21(1318)364)273123(3233(27)163028)12178657917h511131624H121415H214H3
MFCD04159970
ZINC000002405124
ZINC000002405125

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Available files

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