Vitas-M small molecule compound
(2Z)-6-methyl-2-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK798130
SMILES CCCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)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 C25H21N5O3S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O3S/c1-3-13-33-20-11-9-17(10-12-20)22-18(15-29(28-22)19-7-5-4-6-8-19)14-21-24(32)30-25(34-21)26-23(31)16(2)27-30/h4-12,14-15H,3,13H2,1-2H3/b21-14-InChIKey
WZVQEVLFSKWNMP-STZFKDTASA-NSynonyms
(2Z)6methyl2((1phenyl3(4propoxyphenyl)1Hpyrazol4yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2Z)6METHYL2((1PHENYL3(4PROPOXYPHENYL)PYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(Z)6methyl2((1phenyl3(4propoxyphenyl)1Hpyrazol4yl)methylene)2Hthiazolo(32b)(124)triazine37dione
CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)C)S3)C5=CC=CC=C5
CCCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(c(=O)n2)C)c1ccccc1
InChI=1SC25H21N5O3Sc1313332011917(101220)2218(1529(2822)197546819)142124(32)3025(3421)2623(31)16(2)2730h4121415H313H212H3b2114
MFCD02989488
ZINC000013800265
ZINC13800265
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