Vitas-M small molecule compound
N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK287269
SMILES COc1ccc(cc1)c1nnc(n1C)SCC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C
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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 C21H22N6O3S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3S/c1-25-16-10-7-14(11-17(16)26(2)21(25)29)22-18(28)12-31-20-24-23-19(27(20)3)13-5-8-15(30-4)9-6-13/h5-11H,12H2,1-4H3,(H,22,28)InChIKey
HRLKPWDVAVHPOC-UHFFFAOYSA-NSynonyms
931371-76-5931371765
CN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=C(C=C4)OC)N(C1=O)C
InChI=1SC21H22N6O3Sc1251610714(1117(16)26(2)21(25)29)2218(28)123120242319(27(20)3)135815(304)9613h511H12H214H3(H2228)
MFCD09270997
N(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)2((5(4methoxyphenyl)4methyl4H124triazol3yl)sulfanyl)acetamide
N(13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)2((5(4methoxyphenyl)4methyl4H124triazol3yl)thio)acetamide
N(13dimethyl2oxobenzimidazol5yl)2((5(4methoxyphenyl)4methyl124triazol3yl)sulfanyl)acetamide
ZINC000013691300
ZINC13691300
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