Vitas-M small molecule compound
1-{(5Z)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperidine-4-carboxamide
Catalog ID
STK799245
SMILES NC(=O)C1CCN(CC1)C1=NC(=O)/C(=C/c2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)/S1
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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 C32H28FN5O3S MW 581.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28FN5O3S/c33-27-9-5-4-6-23(27)20-41-26-12-10-21(11-13-26)29-24(19-38(36-29)25-7-2-1-3-8-25)18-28-31(40)35-32(42-28)37-16-14-22(15-17-37)30(34)39/h1-13,18-19,22H,14-17,20H2,(H2,34,39)/b28-18-InChIKey
FHLLUKGMZCOHHB-VEILYXNESA-NSynonyms
1((5Z)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo45dihydro13thiazol2yl)piperidine4carboxamide
1((5Z)5((3(4((2FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE4CARBOXAMIDE
C1CN(CCC1C(=O)N)C2=NC(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5F)C6=CC=CC=C6)S2
InChI=1SC32H28FN5O3Sc3327954623(27)204126121021(111326)2924(1938(3629)257213825)182831(40)3532(4228)37161422(151737)30(34)39h113181922H141720H2(H23439)b2818
MFCD03418478
NC(=O)C1CCN(CC1)C1=NC(=O)C(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)S1
ZINC000002671997
ZINC2671997
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