Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-acetylphenyl)-9,11-dioxo-N-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Catalog ID
STK557162
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)C(=O)C)Nc1ccccc1
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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 C29H23N3O4 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O4/c1-17(33)18-11-13-21(14-12-18)32-28(35)23-24(29(32)36)26(27(34)30-20-8-3-2-4-9-20)31-16-15-19-7-5-6-10-22(19)25(23)31/h2-16,23-26H,1H3,(H,30,34)/t23-,24+,25+,26-/m0/s1InChIKey
XXZYYQNCTNLLSN-QUMGSSFMSA-NSynonyms
1013824-34-4(8S8aR11aS11bS)10(4acetylphenyl)911dioxoNphenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1013824344
CC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)NC6=CC=CC=C6
InChI=1SC29H23N3O4c117(33)18111321(141218)3228(35)2324(29(32)36)26(27(34)30208324920)311615197561022(19)25(23)31h2162326H1H3(H3034)t2324+25+26m0s1
MFCD18242985
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1C=Cc1c2cccc1)c1ccc(cc1)C(=O)C)Nc1ccccc1
ZINC000016033471
ZINC16033471
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