Vitas-M small molecule compound
ethyl {[5-(4-chlorophenyl)-4-(4-ethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STL417303
SMILES CCOC(=O)CSc1nnc(n1c1ccc(cc1)CC)c1ccc(cc1)Cl
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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 C20H20ClN3O2S MW 401.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3O2S/c1-3-14-5-11-17(12-6-14)24-19(15-7-9-16(21)10-8-15)22-23-20(24)27-13-18(25)26-4-2/h5-12H,3-4,13H2,1-2H3InChIKey
FTUSECILFMQSEN-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)OCC)C3=CC=C(C=C3)Cl
ethyl((5(4chlorophenyl)4(4ethylphenyl)4H124triazol3yl)sulfanyl)acetate
ethyl2((5(4chlorophenyl)4(4ethylphenyl)124triazol3yl)sulfanyl)acetate
InChI=1SC20H20ClN3O2Sc131451117(12614)2419(157916(21)10815)222320(24)271318(25)2642h512H3413H212H3
MFCD30707140
ZINC000220969201
ZINC220969201
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