Vitas-M small molecule compound
methyl 5-bromo-3-{[(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)acetyl]amino}-1H-indole-2-carboxylate
Catalog ID
STL527671
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCn3c4C1CCCc4c1c3ccc(c1)C)cc(cc2)Br
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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 C27H27BrN4O3 MW 535.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrN4O3/c1-15-6-9-21-18(12-15)17-4-3-5-22-26(17)32(21)11-10-31(22)14-23(33)30-24-19-13-16(28)7-8-20(19)29-25(24)27(34)35-2/h6-9,12-13,22,29H,3-5,10-11,14H2,1-2H3,(H,30,33)InChIKey
UMNQUUFSPAHIMB-UHFFFAOYSA-NSynonyms
858747-24-74640256
858747247
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCn3c4C1CCCc4c1c3ccc(c1)C)cc(cc2)Br
InChI=1SC27H27BrN4O3c115692118(1215)174352226(17)32(21)111031(22)1423(33)3024191316(28)7820(19)2925(24)27(34)352h6912132229H35101114H212H3(H3033)
methyl5bromo3(((8methyl123a456hexahydro3Hpyrazino(321jk)carbazol3yl)acetyl)amino)1Hindole2carboxylate
methyl5bromo3((2(12methyl14diazatetracyclo(7610^(516)0^(1015))hexadeca9(16)10(15)1113tetraen4yl)acetyl)amino)1~(H)indole2carboxylate
methyl5bromo3(2(8methyl3a456tetrahydro1Hpyrazino(321jk)carbazol3(2H)yl)acetamido)1Hindole2carboxylate
MFCD03660271
ZINC000070673182
ZINC000070673185
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