Vitas-M small molecule compound

ethyl 3-{[3,5-dioxo-4-(2-phenylethyl)piperazin-1-yl]sulfonyl}-1H-pyrazole-5-carboxylate

Catalog ID
STL104109
SMILES CCOC(=O)c1[nH]nc(c1)S(=O)(=O)N1CC(=O)N(C(=O)C1)CCc1ccccc1

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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 C18H20N4O6S MW 420.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O6S/c1-2-28-18(25)14-10-15(20-19-14)29(26,27)21-11-16(23)22(17(24)12-21)9-8-13-6-4-3-5-7-13/h3-7,10H,2,8-9,11-12H2,1H3,(H,19,20)
InChIKey
IQUZNAUGDJCYTE-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)nc(c1)S(=O)(=O)N1CC(=O)N(C(=O)C1)CCc1ccccc1
CCOC(=O)C1=NNC(=C1)S(=O)(=O)N2CC(=O)N(C(=O)C2)CCC3=CC=CC=C3
ethyl3((35dioxo4(2phenylethyl)piperazin1yl)sulfonyl)1Hpyrazole5carboxylate
ethyl5(35dioxo4(2phenylethyl)piperazin1yl)sulfonyl1Hpyrazole3carboxylate
InChI=1SC18H20N4O6Sc122818(25)141015(201914)29(2627)211116(23)22(17(24)1221)98136435713h3710H2891112H21H3(H1920)
MFCD15029206
ZINC000021096519
ZINC21096519

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Available files

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