Vitas-M small molecule compound

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

Catalog ID
STK838124
SMILES CCOc1ccc(cc1)c1cc(C)n2c(n1)cc(n2)C(=O)Nc1sc(c(c1C(=O)OCC)C)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 C27H28N4O6S MW 536.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O6S/c1-6-35-18-11-9-17(10-12-18)19-13-15(4)31-21(28-19)14-20(30-31)24(32)29-25-22(26(33)36-7-2)16(5)23(38-25)27(34)37-8-3/h9-14H,6-8H2,1-5H3,(H,29,32)
InChIKey
VQPIFQBDIRZKSG-UHFFFAOYSA-N
Synonyms
313387-78-9
313387789
CCOC1=CC=C(C=C1)C2=NC3=CC(=NN3C(=C2)C)C(=O)NC4=C(C(=C(S4)C(=O)OCC)C)C(=O)OCC
DIETHYL5(((5(4ETHOXYPHENYL)7METHYLPYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
diethyl5(((5(4ethoxyphenyl)7methylpyrazolo(15a)pyrimidin2yl)carbonyl)amino)3methylthiophene24dicarboxylate
DIETHYL5((5(4ETHOXYPHENYL)7METHYLPYRAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
diethyl5(5(4ethoxyphenyl)7methylpyrazolo(15a)pyrimidine2carboxamido)3methylthiophene24dicarboxylate
InChI=1SC27H28N4O6Sc16351811917(101218)191315(4)3121(2819)1420(3031)24(32)292522(26(33)3672)16(5)23(3825)27(34)3783h914H68H215H3(H2932)
MFCD01194509
ZINC000000994220
ZINC00994220
ZINC994220

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Available files

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