Vitas-M small molecule compound
(2Z)-2-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-(4-methylbenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK705262
SMILES COc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)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 C31H25N5O3S MW 547.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N5O3S/c1-19-9-11-21(12-10-19)16-25-29(37)32-31-36(33-25)30(38)27(40-31)17-23-18-35(24-7-5-4-6-8-24)34-28(23)22-13-14-26(39-3)20(2)15-22/h4-15,17-18H,16H2,1-3H3/b27-17-InChIKey
AEEOIXBIASVUPA-PKAZHMFMSA-NSynonyms
956044-80-7(2Z)2((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)6(4methylbenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2Z)2((3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)6((4METHYLPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(Z)2((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)6(4methylbenzyl)2Hthiazolo(32b)(124)triazine37dione
956044807
CC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OC)C)C6=CC=CC=C6)SC3=NC2=O
COc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)C)c1ccccc1
InChI=1SC31H25N5O3Sc11991121(121019)162529(37)323136(3325)30(38)27(4031)17231835(247546824)3428(23)22131426(393)20(2)1522h4151718H16H213H3b2717
MFCD03535623
ZINC000002222464
ZINC2222464
Check stock
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Check stock on Vitas-MAvailable files
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