Vitas-M small molecule compound
2-[5-({2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-phenylacetamide
Catalog ID
STK219060
SMILES COc1ccc2c(c1)sc(n2)NC(=O)CSc1nnc(n1C)CC(=O)Nc1ccccc1
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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 C21H20N6O3S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3S2/c1-27-17(11-18(28)22-13-6-4-3-5-7-13)25-26-21(27)31-12-19(29)24-20-23-15-9-8-14(30-2)10-16(15)32-20/h3-10H,11-12H2,1-2H3,(H,22,28)(H,23,24,29)InChIKey
HKBBTNBMDFFRAU-UHFFFAOYSA-NSynonyms
2(5((2((6METHOXY13BENZOTHIAZOL2YL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)NPHENYLACETAMIDE
2(5(2((6METHOXY13BENZOTHIAZOL2YL)AMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)NPHENYLACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)CC(=O)NC4=CC=CC=C4
InChI=1SC21H20N6O3S2c12717(1118(28)22136435713)252621(27)311219(29)242023159814(302)1016(15)3220h310H1112H212H3(H2228)(H232429)
MFCD07399159
ZINC000009302417
ZINC09302417
ZINC9302417
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