Vitas-M small molecule compound
2-(4-methoxybenzyl)-9,9-dimethyl-12-phenyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Catalog ID
STK270386
SMILES COc1ccc(cc1)Cc1nc2n(n1)cnc1c2C(c2ccccc2)C2=C(O1)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 C28H26N4O3 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3/c1-28(2)14-20(33)24-21(15-28)35-27-25(23(24)18-7-5-4-6-8-18)26-30-22(31-32(26)16-29-27)13-17-9-11-19(34-3)12-10-17/h4-12,16,23H,13-15H2,1-3H3InChIKey
YRFDAIKWXVQTPI-UHFFFAOYSA-NSynonyms
846027-63-22(4methoxybenzyl)99dimethyl12phenyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
2(4methoxybenzyl)99dimethyl12phenyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
846027632
CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)CC5=CC=C(C=C5)OC)C6=CC=CC=C6)C(=O)C1)C
InChI=1SC28H26N4O3c128(2)1420(33)2421(1528)352725(23(24)187546818)263022(3132(26)162927)131791119(343)121017h4121623H1315H213H3
MFCD04172188
ZINC000002420534
ZINC000002420535
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