Vitas-M small molecule compound
2-{[6-cyano-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Catalog ID
STK593289
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc2n1c(Nc1ccccc1)c(C#N)c1c2COC(C1)(C)C
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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 C28H28N6O3S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O3S/c1-4-36-20-12-10-19(11-13-20)30-24(35)17-38-27-33-32-26-23-16-37-28(2,3)14-21(23)22(15-29)25(34(26)27)31-18-8-6-5-7-9-18/h5-13,31H,4,14,16-17H2,1-3H3,(H,30,35)InChIKey
UFJHNFGZLXCJMP-UHFFFAOYSA-NSynonyms
902050-00-42((6cyano88dimethyl5(phenylamino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridin3yl)sulfanyl)N(4ethoxyphenyl)acetamide
2((6cyano88dimethyl5(phenylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridin3yl)thio)N(4ethoxyphenyl)acetamide
902050004
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C(=C(C4=C3COC(C4)(C)C)C#N)NC5=CC=CC=C5
InChI=1SC28H28N6O3Sc143620121019(111320)3024(35)17382733322623163728(23)1421(23)22(1529)25(34(26)27)31188657918h51331H4141617H213H3(H3035)
MFCD06782351
ZINC000097956735
ZINC97956735
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