Vitas-M small molecule compound
methyl 2-{1-[(4-bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL399349
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1ccn(n1)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 C17H13BrN8O2S MW 473.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN8O2S/c1-9-12-15-21-14(11-3-4-24(22-11)8-25-6-10(18)5-20-25)23-26(15)7-19-16(12)29-13(9)17(27)28-2/h3-7H,8H2,1-2H3InChIKey
UUPIEKWEDKJIDL-UHFFFAOYSA-NSynonyms
1005655-57-11005655571
CC1=C(SC2=C1C3=NC(=NN3C=N2)C4=NN(C=C4)CN5C=C(C=N5)Br)C(=O)OC
InChI=1SC17H13BrN8O2Sc1912152114(113424(2211)825610(18)52025)2326(15)71916(12)2913(9)17(27)282h37H8H212H3
METHYL2(1((4BROMO1HPYRAZOL1YL)METHYL)1HPYRAZOL3YL)9METHYLTHIENO(32E)(124)TRIAZOLO(15C)PYRIMIDINE8CARBOXYLATE
MFCD04134801
ZINC000002804148
ZINC02804148
ZINC2804148
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