Vitas-M small molecule compound
(5Z)-2-(4-benzylpiperidin-1-yl)-5-{[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1,3-thiazol-4(5H)-one
Catalog ID
STK816733
SMILES CCOc1ccc(cc1Cl)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 C33H31ClN4O2S MW 583.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31ClN4O2S/c1-2-40-29-14-13-25(20-28(29)34)31-26(22-38(36-31)27-11-7-4-8-12-27)21-30-32(39)35-33(41-30)37-17-15-24(16-18-37)19-23-9-5-3-6-10-23/h3-14,20-22,24H,2,15-19H2,1H3/b30-21-InChIKey
HSGZSMICDIMESQ-OFWBYEQRSA-NSynonyms
(5Z)2(4benzylpiperidin1yl)5((3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)13thiazol4(5H)one
(5Z)2(4BENZYLPIPERIDIN1YL)5((3(3CHLORO4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)13THIAZOL4ONE
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)CC5=CC=CC=C5)C6=CC=CC=C6)Cl
CCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=NC1=O)N1CCC(CC1)Cc1ccccc1)c1ccccc1
InChI=1SC33H31ClN4O2Sc124029141325(2028(29)34)3126(2238(3631)27117481227)213032(39)3533(4130)37171524(161837)192395361023h314202224H21519H21H3b3021
MFCD04572807
ZINC000097946664
ZINC97946664
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