Vitas-M small molecule compound
(2Z)-6-(4-methoxybenzyl)-2-{[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK706056
SMILES COc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C\c1cn(nc1c1ccc3c(c1)CC(O3)C)c1ccccc1)/c2=O
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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 C32H25N5O4S MW 575.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25N5O4S/c1-19-14-22-16-21(10-13-27(22)41-19)29-23(18-36(35-29)24-6-4-3-5-7-24)17-28-31(39)37-32(42-28)33-30(38)26(34-37)15-20-8-11-25(40-2)12-9-20/h3-13,16-19H,14-15H2,1-2H3/b28-17-InChIKey
ZYSHTCGCWLMLBB-QRQIAZFYSA-NSynonyms
(2Z)6((4METHOXYPHENYL)METHYL)2((3(2METHYL23DIHYDRO1BENZOFURAN5YL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(4methoxybenzyl)2((3(2methyl23dihydro1benzofuran5yl)1phenyl1Hpyrazol4yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(4methoxybenzyl)2((3(2methyl23dihydrobenzofuran5yl)1phenyl1Hpyrazol4yl)methylene)2Hthiazolo(32b)(124)triazine37dione
CC1CC2=C(O1)C=CC(=C2)C3=NN(C=C3C=C4C(=O)N5C(=NC(=O)C(=N5)CC6=CC=C(C=C6)OC)S4)C7=CC=CC=C7
COc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1cn(nc1c1ccc3c(c1)CC(O3)C)c1ccccc1)c2=O
InChI=1SC32H25N5O4Sc11914221621(101327(22)4119)2923(1836(3529)246435724)172831(39)3732(4228)3330(38)26(3437)152081125(402)12920h3131619H1415H212H3b2817
MFCD05734560
ZINC000001894008
ZINC000001894012
Check stock
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Check stock on Vitas-MAvailable files
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