Vitas-M small molecule compound

6-(1,3-benzodioxol-5-yl)-3-(pyridin-4-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Catalog ID
STK557750
SMILES n1ccc(cc1)c1nnc2n1N=C(CS2)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 C16H11N5O2S MW 337.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N5O2S/c1-2-13-14(23-9-22-13)7-11(1)12-8-24-16-19-18-15(21(16)20-12)10-3-5-17-6-4-10/h1-7H,8-9H2
InChIKey
OGTAXPGUFDZLPW-UHFFFAOYSA-N
Synonyms
577694-83-8
4(6(2H13BENZODIOXOL5YL)7H(124)TRIAZOLO(34B)(134)THIADIAZIN3YL)PYRIDINE
577694838
6(13benzodioxol5yl)3(pyridin4yl)7H(124)triazolo(34b)(134)thiadiazine
6(13BENZODIOXOL5YL)3PYRIDIN4YL7H(124)TRIAZOLO(34B)(134)THIADIAZINE
6(2HBENZO(34D)13DIOXOLEN5YL)3(4PYRIDYL)7H124TRIAZOLO(34B)134THIADIAZINE
6(benzo(d)(13)dioxol5yl)3(pyridin4yl)7H(124)triazolo(34b)(134)thiadiazine
C1C(=NN2C(=NN=C2S1)C3=CC=NC=C3)C4=CC5=C(C=C4)OCO5
InChI=1SC16H11N5O2Sc121314(2392213)711(1)1282416191815(21(16)2012)1035176410h17H89H2
MFCD04027528
ZINC000000531813
ZINC00531813
ZINC531813

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Available files

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