Vitas-M small molecule compound
N-benzyl-3-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-N-(propan-2-yl)-1H-pyrazole-4-carboxamide
Catalog ID
STL132929
SMILES CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)C(=O)N(C(C)C)Cc1ccccc1
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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 C27H34ClN5O3S MW 544.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34ClN5O3S/c1-5-31-19-24(27(34)33(20(2)3)18-22-9-7-6-8-10-22)26(29-31)37(35,36)32-15-13-30(14-16-32)25-17-23(28)12-11-21(25)4/h6-12,17,19-20H,5,13-16,18H2,1-4H3InChIKey
OLNBMBLDAZOIHM-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)C(=O)N(CC4=CC=CC=C4)C(C)C
InChI=1SC27H34ClN5O3Sc15311924(27(34)33(20(2)3)182297681022)26(2931)37(3536)32151330(141632)251723(28)121121(25)4h612171920H5131618H214H3
MFCD20752872
Nbenzyl3((4(5chloro2methylphenyl)piperazin1yl)sulfonyl)1ethylN(propan2yl)1Hpyrazole4carboxamide
Nbenzyl3(4(5chloro2methylphenyl)piperazin1yl)sulfonyl1ethylNpropan2ylpyrazole4carboxamide
ZINC000102921162
ZINC102921162
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