Vitas-M small molecule compound

(5Z)-2-(4-benzylpiperidin-1-yl)-5-{[3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1,3-thiazol-4(5H)-one

Catalog ID
STK906815
SMILES COc1cccc(c1)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 C32H30N4O2S MW 534.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N4O2S/c1-38-28-14-8-11-25(20-28)30-26(22-36(34-30)27-12-6-3-7-13-27)21-29-31(37)33-32(39-29)35-17-15-24(16-18-35)19-23-9-4-2-5-10-23/h2-14,20-22,24H,15-19H2,1H3/b29-21-
InChIKey
GDWDVQXTYYJBAR-ANYBSYGZSA-N
Synonyms
1010871-47-2
(5Z)2(4benzylpiperidin1yl)5((3(3methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)13thiazol4(5H)one
(5Z)2(4BENZYLPIPERIDIN1YL)5((3(3METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)13THIAZOL4ONE
(Z)2(4benzylpiperidin1yl)5((3(3methoxyphenyl)1phenyl1Hpyrazol4yl)methylene)thiazol4(5H)one
1010871472
COC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)CC5=CC=CC=C5)C6=CC=CC=C6
COc1cccc(c1)c1nn(cc1C=C1SC(=NC1=O)N1CCC(CC1)Cc1ccccc1)c1ccccc1
InChI=1SC32H30N4O2Sc138281481125(2028)3026(2236(3430)27126371327)212931(37)3332(3929)35171524(161835)192394251023h214202224H1519H21H3b2921
MFCD05703908
ZINC000101249898
ZINC101249898

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Available files

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