Vitas-M small molecule compound
9,9-dimethyl-2-[(naphthalen-1-yloxy)methyl]-12-phenyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Catalog ID
STK270391
SMILES O=C1CC(C)(C)CC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)COc1cccc2c1cccc2
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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 C31H26N4O3 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O3/c1-31(2)15-22(36)27-24(16-31)38-30-28(26(27)20-10-4-3-5-11-20)29-33-25(34-35(29)18-32-30)17-37-23-14-8-12-19-9-6-7-13-21(19)23/h3-14,18,26H,15-17H2,1-2H3InChIKey
ZIUHMVIDZUHMBB-UHFFFAOYSA-NSynonyms
848919-41-5848919415
99dimethyl2((naphthalen1yloxy)methyl)12phenyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
99dimethyl2((naphthalen1yloxy)methyl)12phenyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)COC5=CC=CC6=CC=CC=C65)C7=CC=CC=C7)C(=O)C1)C
InChI=1SC31H26N4O3c131(2)1522(36)2724(1631)383028(26(27)20104351120)293325(3435(29)183230)17372314812199671321(19)23h3141826H1517H212H3
MFCD04198428
ZINC000002440967
ZINC000002440969
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