Vitas-M small molecule compound
2-({[5-(4-amino-1,2,5-oxadiazol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK244934
SMILES N#Cc1ccccc1CSc1nnc(n1C)c1nonc1N
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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 C13H11N7OS MW 313.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N7OS/c1-20-12(10-11(15)19-21-18-10)16-17-13(20)22-7-9-5-3-2-4-8(9)6-14/h2-5H,7H2,1H3,(H2,15,19)InChIKey
DEVZHZLDQNKGDZ-UHFFFAOYSA-NSynonyms
2(((5(4amino125oxadiazol3yl)4methyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
2((5(4amino125oxadiazol3yl)4methyl124triazol3yl)sulfanylmethyl)benzonitrile
CN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=NON=C3N
InChI=1SC13H11N7OSc12012(1011(15)19211810)161713(20)227953248(9)614h25H7H21H3(H21519)
MFCD08684913
ZINC000009667277
ZINC09667277
ZINC9667277
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