Vitas-M small molecule compound
methyl 4-[(11aR)-2-(3-methoxyphenyl)-1,3-dioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-5-yl]benzoate
Catalog ID
STL534256
SMILES COc1cccc(c1)N1C(=O)[C@@H]2N(C1=O)C(c1ccc(cc1)C(=O)OC)c1c(C2)c2ccccc2[nH]1
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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 C28H23N3O5 MW 481.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O5/c1-35-19-7-5-6-18(14-19)30-26(32)23-15-21-20-8-3-4-9-22(20)29-24(21)25(31(23)28(30)34)16-10-12-17(13-11-16)27(33)36-2/h3-14,23,25,29H,15H2,1-2H3/t23-,25?/m1/s1InChIKey
VTLYJQOBPFOPKG-XQZUBTRRSA-NSynonyms
44667701
COc1cccc(c1)N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C(=O)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC28H23N3O5c1351975618(1419)3026(32)23152120834922(20)2924(21)25(31(23)28(30)34)16101217(131116)27(33)362h314232529H15H212H3t2325?m1s1
methyl4((11aR)2(3methoxyphenyl)13dioxo23561111ahexahydro1Himidazo(1516)pyrido(34b)indol5yl)benzoate
methyl4((11aS)2(3methoxyphenyl)13dioxo23561111ahexahydro1Himidazo(1516)pyrido(34b)indol5yl)benzoate
methyl4((15~(R))13(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen10yl)benzoate
MFCD03851532
ZINC000002149466
ZINC000002149469
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