Vitas-M small molecule compound

5-(1,3-benzodioxol-5-yl)-2-phenyl-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one

Catalog ID
STK543152
SMILES O=C1CC(Sc2n1nc(n2)c1ccccc1)c1ccc2c(c1)OCO2

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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 C18H13N3O3S MW 351.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O3S/c22-16-9-15(12-6-7-13-14(8-12)24-10-23-13)25-18-19-17(20-21(16)18)11-4-2-1-3-5-11/h1-8,15H,9-10H2
InChIKey
CVWYSKLCXQRQPH-UHFFFAOYSA-N
Synonyms
384849-40-5
(5S)5(13BENZODIOXOL5YL)2PHENYL56DIHYDRO7H(124)TRIAZOLO(51B)(13)THIAZIN7ONE
384849405
5(13BENZODIOXOL5YL)2PHENYL56DIHYDRO(124)TRIAZOLO(51B)(13)THIAZIN7ONE
5(13benzodioxol5yl)2phenyl56dihydro7H(124)triazolo(51b)(13)thiazin7one
5(2HBENZO(34D)13DIOXOLEN5YL)2PHENYL5H6H124TRIAZOLO(51B)13THIAZAPERHYDROIN7ONE
5(benzo(d)(13)dioxol5yl)2phenyl5H(124)triazolo(51b)(13)thiazin7(6H)one
C1C(SC2=NC(=NN2C1=O)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5
InChI=1SC18H13N3O3Sc2216915(12671314(812)24102313)25181917(2021(16)18)114213511h1815H910H2
MFCD02924320
ZINC000001014186
ZINC000001014187

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Available files

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