Vitas-M small molecule compound
(3Z)-3-[2-(3,4-dimethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(4-methylbenzyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK819579
SMILES COc1cc(ccc1OC)c1nn2c(n1)s/c(=C\1/c3ccccc3N(C1=O)Cc1ccc(cc1)C)/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 C28H22N4O4S MW 510.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O4S/c1-16-8-10-17(11-9-16)15-31-20-7-5-4-6-19(20)23(26(31)33)24-27(34)32-28(37-24)29-25(30-32)18-12-13-21(35-2)22(14-18)36-3/h4-14H,15H2,1-3H3/b24-23-InChIKey
WDMWEEJLKIEUAJ-VHXPQNKSSA-NSynonyms
618854-62-9(3Z)3(2(34dimethoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)1(4methylbenzyl)13dihydro2Hindol2one
(5Z)2(34dimethoxyphenyl)5(1((4methylphenyl)methyl)2oxoindol3ylidene)(13)thiazolo(32b)(124)triazol6one
(Z)2(34dimethoxyphenyl)5(1(4methylbenzyl)2oxoindolin3ylidene)thiazolo(32b)(124)triazol6(5H)one
618854629
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C4C(=O)N5C(=NC(=N5)C6=CC(=C(C=C6)OC)OC)S4)C2=O
COc1cc(ccc1OC)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)Cc1ccc(cc1)C)c2=O
InChI=1SC28H22N4O4Sc11681017(11916)153120754619(20)23(26(31)33)2427(34)3228(3724)2925(3032)18121321(352)22(1418)363h414H15H213H3b2423
MFCD04009205
ZINC000003637496
ZINC03637496
ZINC3637496
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.