Vitas-M small molecule compound
1-[9-hydroxy-2-(2-methylpropyl)-10-[3-(pyrimidin-2-yloxy)phenyl]-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl]ethanone
Catalog ID
STL550919
SMILES CC(Cn1cc2c3c1cccc3N=C1C(=C(O)N(C1)C(=O)C)C2c1cccc(c1)Oc1ncccn1)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 C29H27N5O3 MW 493.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O3/c1-17(2)14-33-15-21-25(19-7-4-8-20(13-19)37-29-30-11-6-12-31-29)27-23(16-34(18(3)35)28(27)36)32-22-9-5-10-24(33)26(21)22/h4-13,15,17,25,36H,14,16H2,1-3H3InChIKey
KZDKPHGBXIQRJT-UHFFFAOYSA-NSynonyms
1(9hydroxy2(2methylpropyl)10(3(pyrimidin2yloxy)phenyl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC29H27N5O3c117(2)1433152125(1974820(1319)372930116123129)2723(1634(18(3)35)28(27)36)3222951024(33)26(21)22h41315172536H1416H213H3
MFCD31757849
ZINC000888089137
ZINC000888089138
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