Vitas-M small molecule compound

ethyl 4-{[(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]amino}piperidine-1-carboxylate

Catalog ID
STL133139
SMILES CCOC(=O)N1CCC(CC1)NC(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)CC

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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 C26H38N6O5S MW 546.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H38N6O5S/c1-5-31-18-22(24(33)27-21-10-12-30(13-11-21)26(34)37-6-2)25(28-31)38(35,36)32-16-14-29(15-17-32)23-9-7-8-19(3)20(23)4/h7-9,18,21H,5-6,10-17H2,1-4H3,(H,27,33)
InChIKey
GXEXIHOVENCVEY-UHFFFAOYSA-N
Synonyms

CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)NC4CCN(CC4)C(=O)OCC
ethyl4(((3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)carbonyl)amino)piperidine1carboxylate
ethyl4((3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazole4carbonyl)amino)piperidine1carboxylate
InChI=1SC26H38N6O5Sc15311822(24(33)2721101230(131121)26(34)3762)25(2831)38(3536)32161429(151732)2397819(3)20(23)4h791821H561017H214H3(H2733)
MFCD20753082
ZINC000102920869
ZINC102920869

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Available files

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