Vitas-M small molecule compound

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

Catalog ID
STK706641
SMILES CCOc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCCC(C1)C)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 C27H27ClN4O2S MW 507.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4O2S/c1-3-34-23-12-11-19(14-22(23)28)25-20(17-32(30-25)21-9-5-4-6-10-21)15-24-26(33)29-27(35-24)31-13-7-8-18(2)16-31/h4-6,9-12,14-15,17-18H,3,7-8,13,16H2,1-2H3/b24-15-
InChIKey
URGQQEXQUAKHBV-IWIPYMOSSA-N
Synonyms
1009436-01-4
(5Z)5((3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2(3methylpiperidin1yl)13thiazol4(5H)one
(5Z)5((3(3CHLORO4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(3METHYLPIPERIDIN1YL)13THIAZOL4ONE
(Z)5((3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2(3methylpiperidin1yl)thiazol4(5H)one
1009436014
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCCC(C4)C)C5=CC=CC=C5)Cl
CCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=NC1=O)N1CCCC(C1)C)c1ccccc1
InChI=1SC27H27ClN4O2Sc133423121119(1422(23)28)2520(1732(3025)2195461021)152426(33)2927(3524)31137818(2)1631h4691214151718H3781316H212H3b2415
MFCD04005705
ZINC000002261829
ZINC000013750948

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Available files

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