Vitas-M small molecule compound
3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-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
STK592436
SMILES N#Cc1c(Nc2ccc(cc2)C)n2c(SCc3nc4c([nH]3)cccc4)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 C27H25N7OS MW 495.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N7OS/c1-16-8-10-17(11-9-16)29-24-19(13-28)18-12-27(2,3)35-14-20(18)25-32-33-26(34(24)25)36-15-23-30-21-6-4-5-7-22(21)31-23/h4-11,29H,12,14-15H2,1-3H3,(H,30,31)InChIKey
JXMBUYNNGHPMOJ-UHFFFAOYSA-NSynonyms
906261-58-33(((1Hbenzo(d)imidazol2yl)methyl)thio)88dimethyl5(ptolylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
3((1Hbenzimidazol2ylmethyl)sulfanyl)88dimethyl5((4methylphenyl)amino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
906261583
CC1=CC=C(C=C1)NC2=C(C3=C(COC(C3)(C)C)C4=NN=C(N24)SCC5=NC6=CC=CC=C6N5)C#N
InChI=1SC27H25N7OSc11681017(11916)292419(1328)181227(23)351420(18)25323326(34(24)25)3615233021645722(21)3123h41129H121415H213H3(H3031)
MFCD06780664
N#Cc1c(Nc2ccc(cc2)C)n2c(SCc3nc4c((nH)3)cccc4)nnc2c2c1CC(C)(C)OC2
ZINC000009510670
ZINC09510670
ZINC9510670
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