Vitas-M small molecule compound
4-({[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STL338947
SMILES N#Cc1ccc(cc1)CSc1nnc(n1C)c1cccnc1
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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 C16H13N5S MW 307.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N5S/c1-21-15(14-3-2-8-18-10-14)19-20-16(21)22-11-13-6-4-12(9-17)5-7-13/h2-8,10H,11H2,1H3InChIKey
LMWXZAMCWSOVLR-UHFFFAOYSA-NSynonyms
675842-13-44(((4methyl5(pyridin3yl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((4methyl5(pyridin3yl)4H124triazol3yl)thio)methyl)benzonitrile
4((4METHYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
675842134
CN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=CN=CC=C3
InChI=1SC16H13N5Sc12115(14328181014)192016(21)2211136412(917)5713h2810H11H21H3
MFCD04007553
ZINC000000523684
ZINC00523684
ZINC523684
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