Vitas-M small molecule compound
1-[(5Z)-5-{[3-(4-ethoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperidine-4-carboxamide
Catalog ID
STK799183
SMILES CCOc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCC(CC1)C(=O)N)c1ccccc1
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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 C28H29N5O3S MW 515.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O3S/c1-3-36-22-9-10-23(18(2)15-22)25-20(17-33(31-25)21-7-5-4-6-8-21)16-24-27(35)30-28(37-24)32-13-11-19(12-14-32)26(29)34/h4-10,15-17,19H,3,11-14H2,1-2H3,(H2,29,34)/b24-16-InChIKey
BRXGOSBDYIVNLX-JLPGSUDCSA-NSynonyms
1((5Z)5((3(4ethoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo45dihydro13thiazol2yl)piperidine4carboxamide
1((5Z)5((3(4ETHOXY2METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE4CARBOXAMIDE
CCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)C(=O)N)C5=CC=CC=C5)C
CCOc1ccc(c(c1)C)c1nn(cc1C=C1SC(=NC1=O)N1CCC(CC1)C(=O)N)c1ccccc1
InChI=1SC28H29N5O3Sc13362291023(18(2)1522)2520(1733(3125)217546821)162427(35)3028(3724)32131119(121432)26(29)34h410151719H31114H212H3(H22934)b2416
MFCD03418454
ZINC000016700767
ZINC16700767
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