Vitas-M small molecule compound
(5Z)-5-{[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(morpholin-4-yl)-1,3-thiazol-4(5H)-one
Catalog ID
STK704028
SMILES CCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCOCC1)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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-2-3-15-34-23-11-9-20(10-12-23)25-21(19-31(29-25)22-7-5-4-6-8-22)18-24-26(32)28-27(35-24)30-13-16-33-17-14-30/h4-12,18-19H,2-3,13-17H2,1H3/b24-18-InChIKey
IPTIMESJHZOESC-MOHJPFBDSA-NSynonyms
(5Z)5((3(4butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2(morpholin4yl)13thiazol4(5H)one
(5Z)5((3(4BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2MORPHOLIN4YL13THIAZOL4ONE
(E)5((3(4butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2morpholinothiazol4(5H)one
CCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCOCC4)C5=CC=CC=C5
CCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=NC1=O)N1CCOCC1)c1ccccc1
InChI=1SC27H28N4O3Sc12315342311920(101223)2521(1931(2925)227546822)182426(32)2827(3524)30131633171430h4121819H231317H21H3b2418
MFCD04518798
ZINC000026533602
ZINC26533602
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