Vitas-M small molecule compound

4-({[4-(2-methylpropyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)benzonitrile

Catalog ID
STK497768
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1CC(C)C)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 C20H19N5OS MW 377.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5OS/c1-14(2)12-25-19(17-4-3-9-22-11-17)23-24-20(25)27-13-18(26)16-7-5-15(10-21)6-8-16/h3-9,11,14H,12-13H2,1-2H3
InChIKey
XSNCNBGTBMRJEN-UHFFFAOYSA-N
Synonyms

4(((4(2methylpropyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)acetyl)benzonitrile
4(2((4(2methylpropyl)5pyridin3yl124triazol3yl)sulfanyl)acetyl)benzonitrile
CC(C)CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)C3=CN=CC=C3
InChI=1SC20H19N5OSc114(2)122519(17439221117)232420(25)271318(26)167515(1021)6816h391114H1213H212H3
MFCD11855103
ZINC000008883154
ZINC08883154
ZINC8883154

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Available files

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