Vitas-M small molecule compound
3-(benzylsulfanyl)-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Catalog ID
STK581002
SMILES N#Cc1c(Nc2ccc(cc2)C)n2c(SCc3ccccc3)nnc2c2c1CC(C)(C)OC2
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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 C26H25N5OS MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5OS/c1-17-9-11-19(12-10-17)28-23-21(14-27)20-13-26(2,3)32-15-22(20)24-29-30-25(31(23)24)33-16-18-7-5-4-6-8-18/h4-12,28H,13,15-16H2,1-3H3InChIKey
WPZBGZCSFPSUFE-UHFFFAOYSA-NSynonyms
900884-44-83(benzylsulfanyl)88dimethyl5((4methylphenyl)amino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
3(benzylthio)88dimethyl5(ptolylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
900884448
CC1=CC=C(C=C1)NC2=C(C3=C(COC(C3)(C)C)C4=NN=C(N24)SCC5=CC=CC=C5)C#N
InChI=1SC26H25N5OSc11791119(121017)282321(1427)201326(23)321522(20)24293025(31(23)24)3316187546818h41228H131516H213H3
MFCD06777778
ZINC000009580635
ZINC09580635
ZINC9580635
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