Vitas-M small molecule compound
methyl 2-{5-[(2-methoxyphenoxy)methyl]furan-2-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL177038
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1ccc(o1)COc1ccccc1OC
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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 C22H18N4O5S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O5S/c1-12-17-20-24-19(25-26(20)11-23-21(17)32-18(12)22(27)29-3)16-9-8-13(31-16)10-30-15-7-5-4-6-14(15)28-2/h4-9,11H,10H2,1-3H3InChIKey
YUKNBEBXYNEWKE-UHFFFAOYSA-NSynonyms
828299-04-3828299043
CC1=C(SC2=C1C3=NC(=NN3C=N2)C4=CC=C(O4)COC5=CC=CC=C5OC)C(=O)OC
InChI=1SC22H18N4O5Sc11217202419(2526(20)112321(17)3218(12)22(27)293)169813(3116)103015754614(15)282h4911H10H213H3
methyl2(5((2methoxyphenoxy)methyl)furan2yl)9methylthieno(32e)(124)triazolo(15c)pyrimidine8carboxylate
MFCD04133074
ZINC000002798874
ZINC02798874
ZINC2798874
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