Vitas-M small molecule compound
4-({[4-(prop-2-en-1-yl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STL339699
SMILES C=CCn1c(SCc2ccc(cc2)C#N)nnc1c1nccnc1
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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 C17H14N6S MW 334.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N6S/c1-2-9-23-16(15-11-19-7-8-20-15)21-22-17(23)24-12-14-5-3-13(10-18)4-6-14/h2-8,11H,1,9,12H2InChIKey
IZZMDNJZIRZLNG-UHFFFAOYSA-NSynonyms
674808-47-04(((4(prop2en1yl)5(pyrazin2yl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((4allyl5(pyrazin2yl)4H124triazol3yl)thio)methyl)benzonitrile
4((4PROP2ENYL5PYRAZIN2YL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
4((4PROP2ENYL5PYRAZIN2YL124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
674808470
C=CCN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=NC=CN=C3
InChI=1SC17H14N6Sc1292316(151119782015)212217(23)2412145313(1018)4614h2811H1912H2
MFCD04013252
ZINC000000526868
ZINC00526868
ZINC526868
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