Vitas-M small molecule compound
methyl 5-[(1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazol-1'-yl)methyl]furan-2-carboxylate
Catalog ID
STL412571
SMILES COC(=O)c1ccc(o1)Cn1nc(cc1c1cnn(c1)C)c1cnn(c1)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 C18H18N6O3 MW 366.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O3/c1-22-9-12(7-19-22)15-6-16(13-8-20-23(2)10-13)24(21-15)11-14-4-5-17(27-14)18(25)26-3/h4-10H,11H2,1-3H3InChIKey
XNCBECCDWAQJRT-UHFFFAOYSA-NSynonyms
1006344-11-11006344111
CN1C=C(C=N1)C2=CC(=NN2CC3=CC=C(O3)C(=O)OC)C4=CN(N=C4)C
InChI=1SC18H18N6O3c122912(71922)15616(1382023(2)1013)24(2115)11144517(2714)18(25)263h410H11H213H3
methyl5((11dimethyl1H1H1H4354terpyrazol1yl)methyl)furan2carboxylate
methyl5((35bis(1methylpyrazol4yl)pyrazol1yl)methyl)furan2carboxylate
MFCD08553104
ZINC000017075197
ZINC17075197
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