Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-2-{[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK219390
SMILES COc1cc(ccc1OC)C(=O)CSc1nnc(n1C)c1cc2c(o1)c(OC)ccc2
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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 C22H21N3O5S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5S/c1-25-21(19-11-14-6-5-7-17(28-3)20(14)30-19)23-24-22(25)31-12-15(26)13-8-9-16(27-2)18(10-13)29-4/h5-11H,12H2,1-4H3InChIKey
MOGOYOJHLLZPFN-UHFFFAOYSA-NSynonyms
1(34DIMETHOXYPHENYL)2((5(7METHOXY1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIMETHOXYPHENYL)2((5(7METHOXY1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
CN1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC4=C(O3)C(=CC=C4)OC
InChI=1SC22H21N3O5Sc12521(19111465717(283)20(14)3019)232422(25)311215(26)138916(272)18(1013)294h511H12H214H3
MFCD07401717
ZINC000009302984
ZINC09302984
ZINC9302984
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