Vitas-M small molecule compound
N-(2,5-dichlorophenyl)-2-{[4-ethyl-5-(7-methoxy-1-benzofuran-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK116185
SMILES COc1cccc2c1oc(c2)c1nnc(n1CC)SCC(=O)Nc1cc(Cl)ccc1Cl
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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 C21H18Cl2N4O3S MW 477.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N4O3S/c1-3-27-20(17-9-12-5-4-6-16(29-2)19(12)30-17)25-26-21(27)31-11-18(28)24-15-10-13(22)7-8-14(15)23/h4-10H,3,11H2,1-2H3,(H,24,28)InChIKey
ACSIJFMYPIAIPR-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)Cl)C3=CC4=C(O3)C(=CC=C4)OC
InChI=1SC21H18Cl2N4O3Sc132720(1791254616(292)19(12)3017)252621(27)311118(28)24151013(22)7814(15)23h410H311H212H3(H2428)
MFCD04090992
N(25DICHLOROPHENYL)2((4ETHYL5(7METHOXY1BENZOFURAN2YL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(25DICHLOROPHENYL)2((4ETHYL5(7METHOXY1BENZOFURAN2YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000000687512
ZINC00687512
ZINC687512
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