Vitas-M small molecule compound
(2Z)-6-(4-methylbenzyl)-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
STK904704
SMILES CC1Cc2c(O1)ccc(c2)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 C32H25N5O3S MW 559.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25N5O3S/c1-19-8-10-21(11-9-19)15-26-30(38)33-32-37(34-26)31(39)28(41-32)17-24-18-36(25-6-4-3-5-7-25)35-29(24)22-12-13-27-23(16-22)14-20(2)40-27/h3-13,16-18,20H,14-15H2,1-2H3/b28-17-InChIKey
VHIDLNLNWCYMHF-QRQIAZFYSA-NSynonyms
(2Z)2((3(2METHYL23DIHYDRO1BENZOFURAN5YL)1PHENYLPYRAZOL4YL)METHYLIDENE)6((4METHYLPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(4methylbenzyl)2((3(2methyl23dihydro1benzofuran5yl)1phenyl1Hpyrazol4yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2((3(2methyl23dihydrobenzofuran5yl)1phenyl1Hpyrazol4yl)methylene)6(4methylbenzyl)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)C)S4)C7=CC=CC=C7
CC1Cc2c(O1)ccc(c2)c1nn(cc1C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)C)c1ccccc1
InChI=1SC32H25N5O3Sc11981021(11919)152630(38)333237(3426)31(39)28(4132)17241836(256435725)3529(24)2212132723(1622)1420(2)4027h313161820H1415H212H3b2817
MFCD03535631
ZINC000002555175
ZINC000002555181
Check stock
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Check stock on Vitas-MAvailable files
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