Vitas-M small molecule compound
ethyl [2-(4-methylphenyl)-1,3,4-trioxo-9-phenyldecahydro-3bH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]pyrazin-3b-yl]acetate
Catalog ID
STL361740
SMILES CCOC(=O)CC12C(=O)NCCN1C(C1C2C(=O)N(C1=O)c1ccc(cc1)C)c1ccccc1
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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 C26H27N3O5 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O5/c1-3-34-19(30)15-26-21-20(23(31)29(24(21)32)18-11-9-16(2)10-12-18)22(17-7-5-4-6-8-17)28(26)14-13-27-25(26)33/h4-12,20-22H,3,13-15H2,1-2H3,(H,27,33)InChIKey
SELFMECKQZVAPJ-UHFFFAOYSA-NSynonyms
CCOC(=O)CC12C3C(C(N1CCNC2=O)C4=CC=CC=C4)C(=O)N(C3=O)C5=CC=C(C=C5)C
ethyl(2(4methylphenyl)134trioxo9phenyldecahydro3bHpyrrolo(3434)pyrrolo(12a)pyrazin3byl)acetate
ethyl2(2(4methylphenyl)139trioxo4phenyl3a46789bhexahydropyrrolo(12)pyrrolo(45a)pyrazin9ayl)acetate
InChI=1SC26H27N3O5c133419(30)15262120(23(31)29(24(21)32)1811916(2)101218)22(177546817)28(26)14132725(26)33h4122022H31315H212H3(H2733)
MFCD28033908
ZINC000107913804
ZINC000248121647
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