Vitas-M small molecule compound

ethyl 3-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}-1H-pyrazole-5-carboxylate

Catalog ID
STL104124
SMILES CCOC(=O)c1[nH]nc(c1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)OC

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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 C17H22N4O5S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O5S/c1-3-26-17(22)15-12-16(19-18-15)27(23,24)21-10-8-20(9-11-21)13-4-6-14(25-2)7-5-13/h4-7,12H,3,8-11H2,1-2H3,(H,18,19)
InChIKey
SPFXFBUSVMWQRZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)nc(c1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)OC
CCOC(=O)C1=NNC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC
ethyl3((4(4methoxyphenyl)piperazin1yl)sulfonyl)1Hpyrazole5carboxylate
ethyl5(4(4methoxyphenyl)piperazin1yl)sulfonyl1Hpyrazole3carboxylate
InChI=1SC17H22N4O5Sc132617(22)151216(191815)27(2324)2110820(91121)134614(252)7513h4712H3811H212H3(H1819)
MFCD15029225
ZINC000008611075
ZINC8611075

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Available files

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