Vitas-M small molecule compound
3-(benzylsulfanyl)-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Catalog ID
STK586846
SMILES N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccccc1)c(SCc1ccccc1)nn2
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H23N5OS MW 441.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5OS/c1-25(2)13-19-20(14-26)22(27-18-11-7-4-8-12-18)30-23(21(19)15-31-25)28-29-24(30)32-16-17-9-5-3-6-10-17/h3-12,27H,13,15-16H2,1-2H3InChIKey
CBOLXXKLUTYYHU-UHFFFAOYSA-NSynonyms
900297-96-33(benzylsulfanyl)88dimethyl5(phenylamino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
3(benzylthio)88dimethyl5(phenylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
900297963
CC1(CC2=C(CO1)C3=NN=C(N3C(=C2C#N)NC4=CC=CC=C4)SCC5=CC=CC=C5)C
InChI=1SC25H23N5OSc125(2)131920(1426)22(2718117481218)3023(21(19)153125)282924(30)32161795361017h31227H131516H212H3
MFCD06770875
ZINC000009446651
ZINC09446651
ZINC9446651
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