Vitas-M small molecule compound

diethyl 5-{[(5,7-diphenylpyrazolo[1,5-a]pyrimidin-2-yl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK342814
SMILES CCOC(=O)c1c(NC(=O)c2nn3c(c2)nc(cc3c2ccccc2)c2ccccc2)sc(c1C)C(=O)OCC

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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 C30H26N4O5S MW 554.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O5S/c1-4-38-29(36)25-18(3)26(30(37)39-5-2)40-28(25)32-27(35)22-17-24-31-21(19-12-8-6-9-13-19)16-23(34(24)33-22)20-14-10-7-11-15-20/h6-17H,4-5H2,1-3H3,(H,32,35)
InChIKey
JIYWYNFWFOHDKL-UHFFFAOYSA-N
Synonyms
312635-78-2
312635782
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=CC=C4)C5=CC=CC=C5
diethyl5(((57diphenylpyrazolo(15a)pyrimidin2yl)carbonyl)amino)3methylthiophene24dicarboxylate
DIETHYL5((57DIPHENYLPYRAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
diethyl5(57diphenylpyrazolo(15a)pyrimidine2carboxamido)3methylthiophene24dicarboxylate
ETHYL2((57DIPHENYL(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL))CARBONYLAMINO)5(ETHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC30H26N4O5Sc143829(36)2518(3)26(30(37)3952)4028(25)3227(35)2217243121(19128691319)1623(34(24)3322)2014107111520h617H45H213H3(H3235)
MFCD01051006
ZINC000001894631
ZINC01894631
ZINC1894631

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Available files

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