Vitas-M small molecule compound
(5Z)-2-(4-ethoxyphenyl)-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK880567
SMILES CCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)OCC)c1ccccc1)/s2
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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 C30H25N5O3S MW 535.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O3S/c1-3-37-24-14-10-20(11-15-24)27-22(19-34(32-27)23-8-6-5-7-9-23)18-26-29(36)35-30(39-26)31-28(33-35)21-12-16-25(17-13-21)38-4-2/h5-19H,3-4H2,1-2H3/b26-18-InChIKey
DSJCLJNVVHSSFZ-ITYLOYPMSA-NSynonyms
(5Z)2(4ethoxyphenyl)5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4ETHOXYPHENYL)5((3(4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)OCC)S3)C6=CC=CC=C6
CCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1cn(nc1c1ccc(cc1)OCC)c1ccccc1)s2
InChI=1SC30H25N5O3Sc133724141020(111524)2722(1934(3227)238657923)182629(36)3530(3926)3128(3335)21121625(171321)3842h519H34H212H3b2618
MFCD03497678
ZINC000097946497
ZINC97946497
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