Vitas-M small molecule compound
3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-11-(4-methoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL332956
SMILES COc1ccc(cc1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)c1c(C)n(n(c1=O)c1ccccc1)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 C31H25N7O3 MW 543.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N7O3/c1-18-27(31(40)38(35(18)3)21-10-6-5-7-11-21)36-19(2)32-28-25(30(36)39)26-29(34-24-13-9-8-12-23(24)33-26)37(28)20-14-16-22(41-4)17-15-20/h5-17H,1-4H3InChIKey
VIJHXXULQSSGHM-UHFFFAOYSA-NSynonyms
384801-57-43(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)11(4methoxyphenyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)11(4methoxyphenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
384801574
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=NC4=C(C3=O)C5=NC6=CC=CC=C6N=C5N4C7=CC=C(C=C7)OC)C
InChI=1SC31H25N7O3c11827(31(40)38(35(18)3)21106571121)3619(2)322825(30(36)39)2629(342413981223(24)3326)37(28)20141622(414)171520h517H14H3
MFCD03284492
ZINC000002318993
ZINC2318993
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