Vitas-M small molecule compound
methyl 2-{4-[(4-ethylphenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL177092
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1ccc(cc1)COc1ccc(cc1)CC
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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 C25H22N4O3S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3S/c1-4-16-7-11-19(12-8-16)32-13-17-5-9-18(10-6-17)22-27-23-20-15(2)21(25(30)31-3)33-24(20)26-14-29(23)28-22/h5-12,14H,4,13H2,1-3H3InChIKey
NMUUVMOZPYPUQR-UHFFFAOYSA-NSynonyms
828298-46-0828298460
CCC1=CC=C(C=C1)OCC2=CC=C(C=C2)C3=NN4C=NC5=C(C4=N3)C(=C(S5)C(=O)OC)C
InChI=1SC25H22N4O3Sc141671119(12816)3213175918(10617)2227232015(2)21(25(30)313)3324(20)261429(23)2822h51214H413H213H3
methyl2(4((4ethylphenoxy)methyl)phenyl)9methylthieno(32e)(124)triazolo(15c)pyrimidine8carboxylate
MFCD04132948
ZINC000002798656
ZINC02798656
ZINC2798656
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