Vitas-M small molecule compound
(5Z)-2-(4-benzylpiperidin-1-yl)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1,3-thiazol-4(5H)-one
Catalog ID
STK823417
SMILES Fc1ccc(cc1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCC(CC1)Cc1ccccc1)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 C31H27FN4OS MW 522.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27FN4OS/c32-26-13-11-24(12-14-26)29-25(21-36(34-29)27-9-5-2-6-10-27)20-28-30(37)33-31(38-28)35-17-15-23(16-18-35)19-22-7-3-1-4-8-22/h1-14,20-21,23H,15-19H2/b28-20-InChIKey
CBYZWCPTRIPGLU-RRAHZORUSA-NSynonyms
(5Z)2(4benzylpiperidin1yl)5((3(4fluorophenyl)1phenyl1Hpyrazol4yl)methylidene)13thiazol4(5H)one
(5Z)2(4benzylpiperidin1yl)5((3(4fluorophenyl)1phenylpyrazol4yl)methylidene)13thiazol4one
C1CN(CCC1CC2=CC=CC=C2)C3=NC(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)F)C6=CC=CC=C6)S3
Fc1ccc(cc1)c1nn(cc1C=C1SC(=NC1=O)N1CCC(CC1)Cc1ccccc1)c1ccccc1
InChI=1SC31H27FN4OSc3226131124(121426)2925(2136(3429)2795261027)202830(37)3331(3828)35171523(161835)19227314822h114202123H1519H2b2820
MFCD03463938
ZINC000027019578
ZINC27019578
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