Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
Catalog ID
STK984049
SMILES COCCn1c(C)cc(c1C)C(=O)CSc1nnc(n1C)c1cc2c(o1)cccc2
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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 C22H24N4O3S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3S/c1-14-11-17(15(2)26(14)9-10-28-4)18(27)13-30-22-24-23-21(25(22)3)20-12-16-7-5-6-8-19(16)29-20/h5-8,11-12H,9-10,13H2,1-4H3InChIKey
CGZDUZRFOXNDDE-UHFFFAOYSA-NSynonyms
929832-70-22((5(1benzofuran2yl)4methyl124triazol3yl)sulfanyl)1(1(2methoxyethyl)25dimethylpyrrol3yl)ethanone
2((5(1benzofuran2yl)4methyl4H124triazol3yl)sulfanyl)1(1(2methoxyethyl)25dimethyl1Hpyrrol3yl)ethanone
2((5(benzofuran2yl)4methyl4H124triazol3yl)thio)1(1(2methoxyethyl)25dimethyl1Hpyrrol3yl)ethanone
929832702
CC1=CC(=C(N1CCOC)C)C(=O)CSC2=NN=C(N2C)C3=CC4=CC=CC=C4O3
InChI=1SC22H24N4O3Sc1141117(15(2)26(14)910284)18(27)133022242321(25(22)3)201216756819(16)2920h581112H91013H214H3
MFCD09218550
ZINC000009575344
ZINC09575344
ZINC9575344
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