Vitas-M small molecule compound

(8S,8aR,11aS)-N-(4-methoxyphenyl)-9,11-dioxo-10-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide

Catalog ID
STK571764
SMILES COc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3

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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 C28H23N3O4 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O4/c1-35-20-13-11-18(12-14-20)29-26(32)25-23-22(24-21-10-6-5-7-17(21)15-16-30(24)25)27(33)31(28(23)34)19-8-3-2-4-9-19/h2-16,22-25H,1H3,(H,29,32)/t22-,23+,24?,25-/m0/s1
InChIKey
LKZBLJXQHFYYFM-NPZNXQLHSA-N
Synonyms
1013836-51-5
(8S8aR11aS)N(4methoxyphenyl)911dioxo10phenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1013836515
COC1=CC=C(C=C1)NC(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=CC=C6
COc1ccc(cc1)NC(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccccc1)cccc3
InChI=1SC28H23N3O4c13520131118(121420)2926(32)252322(24211065717(21)151630(24)25)27(33)31(28(23)34)198324919h2162225H1H3(H2932)t2223+24?25m0s1
MFCD18245426
ZINC000027075923
ZINC000095346116

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Available files

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