Vitas-M small molecule compound
azepan-1-yl(3-{[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl}-1-propyl-1H-pyrazol-4-yl)methanone
Catalog ID
STL132599
SMILES CCCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1ccccc1OCC)C(=O)N1CCCCCC1
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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 C25H37N5O4S MW 503.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H37N5O4S/c1-3-13-29-20-21(25(31)28-14-9-5-6-10-15-28)24(26-29)35(32,33)30-18-16-27(17-19-30)22-11-7-8-12-23(22)34-4-2/h7-8,11-12,20H,3-6,9-10,13-19H2,1-2H3InChIKey
SYHVESNQPAATAB-UHFFFAOYSA-NSynonyms
azepan1yl(3((4(2ethoxyphenyl)piperazin1yl)sulfonyl)1propyl1Hpyrazol4yl)methanone
azepan1yl(3(4(2ethoxyphenyl)piperazin1yl)sulfonyl1propylpyrazol4yl)methanone
CCCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OCC)C(=O)N4CCCCCC4
InChI=1SC25H37N5O4Sc1313292021(25(31)2814956101528)24(2629)35(3233)30181627(171930)2211781223(22)3442h78111220H369101319H212H3
MFCD20752541
ZINC000067337036
ZINC67337036
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