Vitas-M small molecule compound
2-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL402034
SMILES Brc1cnn(c1)Cc1ccc(cc1)c1nn2c(n1)c1sc3c(c1nc2)c(C)cc(n3)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 C22H16BrN7S MW 490.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN7S/c1-12-7-13(2)26-22-17(12)18-19(31-22)21-27-20(28-30(21)11-24-18)15-5-3-14(4-6-15)9-29-10-16(23)8-25-29/h3-8,10-11H,9H2,1-2H3InChIKey
DNKPEPMHQZXUAO-UHFFFAOYSA-NSynonyms
1005617-23-11005617231
2(4((4bromo1Hpyrazol1yl)methyl)phenyl)79dimethylpyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)C5=CC=C(C=C5)CN6C=C(C=N6)Br)C
InChI=1SC22H16BrN7Sc112713(2)262217(12)1819(3122)212720(2830(21)112418)155314(4615)9291016(23)82529h381011H9H212H3
MFCD06197269
ZINC000022748415
ZINC22748415
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