Vitas-M small molecule compound

3-(4-methyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl)pyridine

Catalog ID
STL144804
SMILES Cn1c(SC/C=C/c2ccccc2)nnc1c1cccnc1

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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 C17H16N4S MW 308.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4S/c1-21-16(15-10-5-11-18-13-15)19-20-17(21)22-12-6-9-14-7-3-2-4-8-14/h2-11,13H,12H2,1H3/b9-6+
InChIKey
NGNVXKLMUZIYIH-RMKNXTFCSA-N
Synonyms
573670-09-4
(E)3(5(cinnamylthio)4methyl4H124triazol3yl)pyridine
3((2E)3PHENYLPROP2ENYLTHIO)4METHYL5(3PYRIDYL)124TRIAZOLE
3(4METHYL5(((2E)3PHENYLPROP2EN1YL)SULFANYL)4H124TRIAZOL3YL)PYRIDINE
3(4METHYL5((3PHENYL2PROPEN1YL)THIO)4H124TRIAZOL3YL)PYRIDINE
3(4METHYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOL3YL)PYRIDINE
3(5(CINNAMYLTHIO)4METHYL4H124TRIAZOL3YL)PYRIDINE
573670094
CN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=CN=CC=C3
Cn1c(SCC=Cc2ccccc2)nnc1c1cccnc1
InChI=1SC17H16N4Sc12116(1510511181315)192017(21)221269147324814h21113H12H21H3b96+
MFCD04017425
ZINC000002082554
ZINC02082554
ZINC2082554

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Available files

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