Vitas-M small molecule compound

[4-(2-methylbenzyl)piperazin-1-yl]{1-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]piperidin-3-yl}methanone

Catalog ID
STL401708
SMILES O=C(C1CCCN(C1)S(=O)(=O)c1cnn(c1)C)N1CCN(CC1)Cc1ccccc1C

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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 C22H31N5O3S MW 445.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O3S/c1-18-6-3-4-7-19(18)15-25-10-12-26(13-11-25)22(28)20-8-5-9-27(16-20)31(29,30)21-14-23-24(2)17-21/h3-4,6-7,14,17,20H,5,8-13,15-16H2,1-2H3
InChIKey
IYPGURMRHCFAJT-UHFFFAOYSA-N
Synonyms
1005573-08-9
(4((2methylphenyl)methyl)piperazin1yl)(1(1methylpyrazol4yl)sulfonylpiperidin3yl)methanone
(4(2methylbenzyl)piperazin1yl)(1((1methyl1Hpyrazol4yl)sulfonyl)piperidin3yl)methanone
1005573089
CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CN(N=C4)C
InChI=1SC22H31N5O3Sc118634719(18)1525101226(131125)22(28)2085927(1620)31(2930)21142324(2)1721h3467141720H58131516H212H3
MFCD04136642
ZINC000019643915
ZINC000019643917

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Available files

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