Vitas-M small molecule compound
4-({[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK249795
SMILES N#Cc1ccc(cc1)CSc1nnc(n1C)c1ccc2c(c1)OCCO2
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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 C19H16N4O2S MW 364.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O2S/c1-23-18(15-6-7-16-17(10-15)25-9-8-24-16)21-22-19(23)26-12-14-4-2-13(11-20)3-5-14/h2-7,10H,8-9,12H2,1H3InChIKey
SAQPUCLLTNQYOX-UHFFFAOYSA-NSynonyms
4(((5(23DIHYDRO14BENZODIOXIN6YL)4METHYL4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
4((5(23dihydro14benzodioxin6yl)4methyl124triazol3yl)sulfanylmethyl)benzonitrile
CN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=CC4=C(C=C3)OCCO4
InChI=1SC19H16N4O2Sc12318(15671617(1015)25982416)212219(23)2612144213(1120)3514h2710H8912H21H3
MFCD08672383
ZINC000009668578
ZINC09668578
ZINC9668578
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