Vitas-M small molecule compound

2-(4-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}phenyl)-1,5-dimethyl-4-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one

Catalog ID
STK665685
SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)n1c(=O)c(c(n1C)C)C(C)C

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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 C25H32N4O4S MW 484.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O4S/c1-18(2)24-19(3)26(4)29(25(24)30)21-8-12-23(13-9-21)34(31,32)28-16-14-27(15-17-28)20-6-10-22(33-5)11-7-20/h6-13,18H,14-17H2,1-5H3
InChIKey
IQMCKCWTFWJDRX-UHFFFAOYSA-N
Synonyms

2(4((4(4methoxyphenyl)piperazin1yl)sulfonyl)phenyl)15dimethyl4(propan2yl)12dihydro3Hpyrazol3one
2(4(4(4methoxyphenyl)piperazin1yl)sulfonylphenyl)15dimethyl4propan2ylpyrazol3one
CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)C(C)C
InChI=1SC25H32N4O4Sc118(2)2419(3)26(4)29(25(24)30)2181223(13921)34(3132)28161427(151728)2061022(335)11720h61318H1417H215H3
MFCD09064852
ZINC000012372066
ZINC12372066

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Available files

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