Vitas-M small molecule compound
methyl 2-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL397437
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1ccc(cc1)Cn1ncc(c1)Br
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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 C20H15BrN6O2S MW 483.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN6O2S/c1-11-15-18-24-17(25-27(18)10-22-19(15)30-16(11)20(28)29-2)13-5-3-12(4-6-13)8-26-9-14(21)7-23-26/h3-7,9-10H,8H2,1-2H3InChIKey
BCMXWYWZBSOBMX-UHFFFAOYSA-NSynonyms
1005623-79-91005623799
CC1=C(SC2=C1C3=NC(=NN3C=N2)C4=CC=C(C=C4)CN5C=C(C=N5)Br)C(=O)OC
InChI=1SC20H15BrN6O2Sc11115182417(2527(18)102219(15)3016(11)20(28)292)135312(4613)826914(21)72326h37910H8H212H3
METHYL2(4((4BROMO1HPYRAZOL1YL)METHYL)PHENYL)9METHYLTHIENO(32E)(124)TRIAZOLO(15C)PYRIMIDINE8CARBOXYLATE
MFCD04132891
ZINC000002798564
ZINC02798564
ZINC2798564
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