Vitas-M small molecule compound
methyl 5-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-3-ethyl-1H-pyrazole-4-carboxylate
Catalog ID
STL185795
SMILES COC(=O)c1c(CC)n[nH]c1S(=O)(=O)N1CCN(CC1)c1cccc(c1)Cl
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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 C17H21ClN4O4S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21ClN4O4S/c1-3-14-15(17(23)26-2)16(20-19-14)27(24,25)22-9-7-21(8-10-22)13-6-4-5-12(18)11-13/h4-6,11H,3,7-10H2,1-2H3,(H,19,20)InChIKey
CBDGBPOJBYHDRV-UHFFFAOYSA-NSynonyms
CCC1=C(C(=NN1)S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)OC
COC(=O)c1c(CC)n(nH)c1S(=O)(=O)N1CCN(CC1)c1cccc(c1)Cl
InChI=1SC17H21ClN4O4Sc131415(17(23)262)16(201914)27(2425)229721(81022)1364512(18)1113h4611H3710H212H3(H1920)
methyl3(4(3chlorophenyl)piperazin1yl)sulfonyl5ethyl1Hpyrazole4carboxylate
methyl5((4(3chlorophenyl)piperazin1yl)sulfonyl)3ethyl1Hpyrazole4carboxylate
MFCD22387579
ZINC000072329890
ZINC72329890
Check stock
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