Vitas-M small molecule compound

(3Z)-1-(4-methylbenzyl)-3-[6-oxo-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one

Catalog ID
STK799811
SMILES COc1cc(cc(c1OC)OC)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 C29H24N4O5S MW 540.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O5S/c1-16-9-11-17(12-10-16)15-32-20-8-6-5-7-19(20)23(27(32)34)25-28(35)33-29(39-25)30-26(31-33)18-13-21(36-2)24(38-4)22(14-18)37-3/h5-14H,15H2,1-4H3/b25-23-
InChIKey
XCXKPXGSUGRJFK-BZZOAKBMSA-N
Synonyms

(3Z)1(4methylbenzyl)3(6oxo2(345trimethoxyphenyl)(13)thiazolo(32b)(124)triazol5(6H)ylidene)13dihydro2Hindol2one
(5Z)5(1((4methylphenyl)methyl)2oxoindol3ylidene)2(345trimethoxyphenyl)(13)thiazolo(32b)(124)triazol6one
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C4C(=O)N5C(=NC(=N5)C6=CC(=C(C(=C6)OC)OC)OC)S4)C2=O
COc1cc(cc(c1OC)OC)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)Cc1ccc(cc1)C)c2=O
InChI=1SC29H24N4O5Sc11691117(121016)153220865719(20)23(27(32)34)2528(35)3329(3925)3026(3133)181321(362)24(384)22(1418)373h514H15H214H3b2523
MFCD04446967
ZINC000003637502
ZINC3637502

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Available files

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