Vitas-M small molecule compound
5-(8-acetyl-9-hydroxy-2-methyl-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL551533
SMILES CC(=O)N1CC2=Nc3cccc4c3c(C(C2=C1O)c1ccc2c(c1)n(C)c(=O)n2C)cn4C
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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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c1-13(31)30-12-17-23(24(30)32)21(14-8-9-18-20(10-14)29(4)25(33)28(18)3)15-11-27(2)19-7-5-6-16(26-17)22(15)19/h5-11,21,32H,12H2,1-4H3InChIKey
NKNDFAQLIODUIV-UHFFFAOYSA-NSynonyms
5(8acetyl9hydroxy2methyl27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)13dimethyl13dihydro2Hbenzimidazol2one
InChI=1SC25H23N5O3c113(31)30121723(24(30)32)21(14891820(1014)29(4)25(33)28(18)3)151127(2)1975616(2617)22(15)19h5112132H12H214H3
MFCD31758193
ZINC000888089890
ZINC000888089891
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