Vitas-M small molecule compound
{1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-phenyl-1H-pyrazol-3-yl}[4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Catalog ID
STL441939
SMILES Clc1ccc(cc1)c1csc(n1)n1nc(cc1c1ccccc1)C(=O)N1CCN(CC1)c1ncccn1
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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 C27H22ClN7OS MW 528.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN7OS/c28-21-9-7-19(8-10-21)23-18-37-27(31-23)35-24(20-5-2-1-3-6-20)17-22(32-35)25(36)33-13-15-34(16-14-33)26-29-11-4-12-30-26/h1-12,17-18H,13-16H2InChIKey
AKYYIKUBZPBCLT-UHFFFAOYSA-NSynonyms
(1(4(4chlorophenyl)13thiazol2yl)5phenyl1Hpyrazol3yl)(4(pyrimidin2yl)piperazin1yl)methanone
(1(4(4chlorophenyl)13thiazol2yl)5phenylpyrazol3yl)(4pyrimidin2ylpiperazin1yl)methanone
(1(4(4CHLOROPHENYL)THIAZOL2YL)5PHENYL1HPYRAZOL3YL)(4(PYRIMIDIN2YL)PIPERAZIN1YL)METHANONE
C1CN(CCN1C2=NC=CC=N2)C(=O)C3=NN(C(=C3)C4=CC=CC=C4)C5=NC(=CS5)C6=CC=C(C=C6)Cl
InChI=1SC27H22ClN7OSc28219719(81021)23183727(3123)3524(205213620)1722(3235)25(36)33131534(161433)2629114123026h1121718H1316H2
MFCD09992627
ZINC000101377260
ZINC101377260
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