Vitas-M small molecule compound

methyl (2Z)-{4-oxo-2-[(2E)-2-(4,4,6-trimethyl-2-oxo-6-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene)hydrazinyl]-1,3-thiazol-5(4H)-ylidene}ethanoate

Catalog ID
STL584124
SMILES COC(=O)/C=C/1\SC(=NC1=O)N/N=C\1/C(=O)N2c3c1cccc3C(CC2(C)C)(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 C26H24N4O4S MW 488.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4S/c1-25(2)14-26(3,15-9-6-5-7-10-15)17-12-8-11-16-20(23(33)30(25)21(16)17)28-29-24-27-22(32)18(35-24)13-19(31)34-4/h5-13H,14H2,1-4H3,(H,27,29,32)/b18-13-,28-20+
InChIKey
WCMRHNMPMLJLCV-YMKWJZDCSA-N
Synonyms

InChI=1SC26H24N4O4Sc125(2)1426(31596571015)17128111620(23(33)30(25)21(16)17)2829242722(32)18(3524)1319(31)344h513H14H214H3(H272932)b18132820+
methyl(2Z)(4oxo2((2E)2(446trimethyl2oxo6phenyl56dihydro4Hpyrrolo(321ij)quinolin1(2H)ylidene)hydrazinyl)13thiazol5(4H)ylidene)ethanoate

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.