Vitas-M small molecule compound

(5Z)-5-(2H-chromen-3-ylmethylidene)-2-(2-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK851852
SMILES COc1ccccc1c1nn2c(n1)s/c(=C\C1=Cc3c(OC1)cccc3)/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 C21H15N3O3S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O3S/c1-26-17-9-5-3-7-15(17)19-22-21-24(23-19)20(25)18(28-21)11-13-10-14-6-2-4-8-16(14)27-12-13/h2-11H,12H2,1H3/b18-11-
InChIKey
OMIVRCYRNLIVBF-WQRHYEAKSA-N
Synonyms
585550-47-6
(5Z)5(2Hchromen3ylmethylidene)2(2methoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5(2HCHROMEN3YLMETHYLIDENE)2(2METHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((2Hchromen3yl)methylene)2(2methoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
585550476
COC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC5=CC=CC=C5OC4)SC3=N2
COc1ccccc1c1nn2c(n1)sc(=CC1=Cc3c(OC1)cccc3)c2=O
InChI=1SC21H15N3O3Sc12617953715(17)19222124(2319)20(25)18(2821)11131014624816(14)271213h211H12H21H3b1811
MFCD04029939
ZINC000002391256
ZINC000254344448
ZINC02391256
ZINC2391256

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Available files

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