Vitas-M small molecule compound
9-(difluoromethyl)-2-{3-[(4-ethoxyphenoxy)methyl]phenyl}-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL174202
SMILES CCOc1ccc(cc1)OCc1cccc(c1)c1nn2c(n1)c1sc3c(c1nc2)c(C)cc(n3)C(F)F
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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 C27H21F2N5O2S MW 517.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21F2N5O2S/c1-3-35-18-7-9-19(10-8-18)36-13-16-5-4-6-17(12-16)25-32-26-23-22(30-14-34(26)33-25)21-15(2)11-20(24(28)29)31-27(21)37-23/h4-12,14,24H,3,13H2,1-2H3InChIKey
UFTMPIQGFIXVCA-UHFFFAOYSA-NSynonyms
881485-00-3881485003
9(difluoromethyl)2(3((4ethoxyphenoxy)methyl)phenyl)7methylpyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CCOC1=CC=C(C=C1)OCC2=CC=CC(=C2)C3=NN4C=NC5=C(C4=N3)SC6=C5C(=CC(=N6)C(F)F)C
InChI=1SC27H21F2N5O2Sc1335187919(10818)36131654617(1216)2532262322(301434(26)3325)2115(2)1120(24(28)29)3127(21)3723h4121424H313H212H3
MFCD08554391
ZINC000013644148
ZINC13644148
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