Vitas-M small molecule compound
3-cyclohexyl-2-ethyl-11-(4-phenoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225896
SMILES CCc1nc2n(c3ccc(cc3)Oc3ccccc3)c3c(c2c(=O)n1C1CCCCC1)nc1c(n3)cccc1
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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 C32H29N5O2 MW 515.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O2/c1-2-27-35-30-28(32(38)36(27)21-11-5-3-6-12-21)29-31(34-26-16-10-9-15-25(26)33-29)37(30)22-17-19-24(20-18-22)39-23-13-7-4-8-14-23/h4,7-10,13-21H,2-3,5-6,11-12H2,1H3InChIKey
XJPORUHAVRESTE-UHFFFAOYSA-NSynonyms
381185-61-1381185611
3cyclohexyl2ethyl11(4phenoxyphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3cyclohexyl2ethyl11(4phenoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)OC6=CC=CC=C6)C(=O)N1C7CCCCC7
InChI=1SC32H29N5O2c1227353028(32(38)36(27)21115361221)2931(3426161091525(26)3329)37(30)22171924(201822)3923137481423h47101321H23561112H21H3
MFCD02993513
ZINC000009158122
ZINC09158122
ZINC9158122
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