Vitas-M small molecule compound
ethyl ({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
Catalog ID
STK589333
SMILES CCOC(=O)CSc1nnc2n1c(Nc1ccc(cc1)C)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 C23H25N5O3S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O3S/c1-5-30-19(29)13-32-22-27-26-21-18-12-31-23(3,4)10-16(18)17(11-24)20(28(21)22)25-15-8-6-14(2)7-9-15/h6-9,25H,5,10,12-13H2,1-4H3InChIKey
KGSZWTSSAQVPBJ-UHFFFAOYSA-NSynonyms
902051-26-7902051267
CCOC(=O)CSC1=NN=C2N1C(=C(C3=C2COC(C3)(C)C)C#N)NC4=CC=C(C=C4)C
ethyl((6cyano88dimethyl5((4methylphenyl)amino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridin3yl)sulfanyl)acetate
ethyl2((6cyano88dimethyl5(ptolylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridin3yl)thio)acetate
InChI=1SC23H25N5O3Sc153019(29)13322227262118123123(34)1016(18)17(1124)20(28(21)22)25158614(2)7915h6925H5101213H214H3
MFCD06782465
ZINC000009187838
ZINC09187838
ZINC9187838
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